SCHEMBL3437802

SCHEMBL3437802

Cc1cccc(C)c1OBO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SCN4A P35499 7/20 0.38
CYP1A2 P05177 3/20 0.38
TSHR P16473 3/20 0.38
LMNA P02545 2/20 0.38
SCN1A P35498 2/20 0.38
SCN5A Q14524 2/20 0.38
SCN9A Q15858 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
NFKB1 P19838 2/20 0.38
CYP2A6 P11509 1/20 0.38
CYP2C9 P11712 1/20 0.38
KCNK3 O14649 1/20 0.38
CACNA1F O60840 1/20 0.38
KCNK2 O95069 1/20 0.38
GBA1 P04062 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14768539 0.87 TRPA1 (0.46) ALDH1A1KDM4EHPGDHSD17B10SCN4A
SCHEMBL20315134 0.85 ACHE (0.43) ALDH1A1KDM4EHPGDHSD17B10SCN4A
SCHEMBL18017367 0.83 SMN1; SMN2 (0.42) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL840457 0.79 CYP1A2 (0.41) ALDH1A1KDM4EHPGDHSD17B10SCN4A
SCHEMBL6140636 0.75 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDHSD17B10SCN4A
SCHEMBL3437814 0.75 RAPGEF4 (0.35) ALDH1A1KDM4ELMNAACHECA1
SCHEMBL11940773 0.75 HTR1B (0.47) ALDH1A1KDM4ECYP1A2LMNACYP3A4
SCHEMBL9132 0.73 KDM4E (0.46) ALDH1A1KDM4ESCN4ACYP1A2TSHR
SCHEMBL19080432 0.73 TSHR (0.48) ALDH1A1HPGDHSD17B10CYP1A2TSHR
SCHEMBL30928360 0.71 SCN4A (0.35) ALDH1A1KDM4EHPGDHSD17B10SCN4A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184915-A Propylene and alpha-olefin multi-block copolymer elastomer material, and preparation method and application thereof 天津大学 2024-06-14 CN claimed
CN-112839951-A Synthesis of echinocandin antifungal agents 奇达拉治疗公司 2021-05-25 CN disclosed
US-9905767-B2 High-molecular compound and light-emitting element using same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-27 US disclosed
US-9843003-B2 Organometallic complex, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-12-12 US disclosed
US-9586909-B2 Compound of synthetic intermediate SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-03-07 US disclosed
US-9534006-B2 Organometallic complex, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-01-03 US disclosed
US-9453103-B2 Method for producing aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-09-27 US disclosed
US-20160108006-A1 Synthesis Method of Organometallic Complex, Synthesis Method of Pyrazine Derivative, 5,6-Diaryl-2-Pyrazyl Triflate, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-04-21 US disclosed
US-9231217-B2 Synthesis method of organometallic complex, synthesis method of pyrazine derivative, 5,6-diaryl-2-pyrazyl triflate, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-01-05 US disclosed
US-20150376217-A1 Organometallic Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-12-31 US disclosed
US-9127032-B2 Organometallic complex, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-09-08 US disclosed
US-20150212450-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE, DISPLAY APPARATUS, IMAGE INFORMATION PROCESSING APPARATUS, LIGHTING SYSTEM, AND IMAGE FORMING APPARATUS HAVING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2015-07-30 US disclosed
US-20150207077-A1 HIGH-MOLECULAR COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-07-23 US disclosed
US-20150147840-A1 Synthesis Method of Organometallic Complex, Synthesis Method of Pyrazine Derivative, 5,6-Diaryl-2-Pyrazyl Triflate, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2015-05-28 US disclosed
US-8932736-B2 Organic compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2015-01-13 US disclosed
US-8822043-B2 Organic compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2014-09-02 US disclosed
US-20130165653-A1 Organometallic Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-06-27 US disclosed
US-8361959-B2 Spiro-imidazolone derivatives as glucagon receptor antagonists MERCK SHARP & DOHME CORP. (US) 2013-01-29 US disclosed
US-20120313085-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2012-12-13 US disclosed
US-20120091450-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2012-04-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150147840-A1 Synthesis Method of Organometallic Complex, Synthesis Method of Pyrazine Derivative, 5,6-Diaryl-2-Pyrazyl Triflate, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device DDT, TLL2, PPOX ALDH1A1 1405/4885KDM4E 1475/4885HPGD 1566/4885
US-20130165653-A1 Organometallic Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device LAGE3, NR2E3, IK ALDH1A1 338/4885KDM4E 1054/4885HPGD 2432/4885
US-20120313085-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE MRPL38, CRY1, TYR ALDH1A1 459/4885KDM4E 2901/4885HPGD 4268/4885
US-20160108006-A1 Synthesis Method of Organometallic Complex, Synthesis Method of Pyrazine Derivative, 5,6-Diaryl-2-Pyrazyl Triflate, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device DDT, TLL2, PPOX ALDH1A1 1405/4885KDM4E 1475/4885HPGD 1566/4885
US-20120091450-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE TRPA1, AFF4, TYR ALDH1A1 189/4885KDM4E 1988/4885HPGD 3126/4885
US-20150207077-A1 HIGH-MOLECULAR COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME ARL1, GRK1, GNA11 ALDH1A1 315/4885KDM4E 3774/4885HPGD 4416/4885
US-20150376217-A1 Organometallic Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device LAGE3, NR2E3, IK ALDH1A1 338/4885KDM4E 1054/4885HPGD 2432/4885
US-20150212450-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE, DISPLAY APPARATUS, IMAGE INFORMATION PROCESSING APPARATUS, LIGHTING SYSTEM, AND IMAGE FORMING APPARATUS HAVING THE COMPOUND COG1, OCIAD1, COG6 ALDH1A1 657/4885KDM4E 4399/4885HPGD 3080/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.