SCHEMBL1723554

SCHEMBL1723554

c1ccc(Cc2nccn2Cc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.57
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
ALOX12 P18054 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
FDPS P14324 1/20 0.46
OPRD1 P41143 1/20 0.45
OPRK1 P41145 1/20 0.45
HSP90AB1 P08238 1/20 0.44
HSP90B1 P14625 1/20 0.44
LMNA P02545 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
TNF P01375 1/20 0.43
CYP11B1 P15538 1/20 0.43

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
Hydrochloric Acid SCHEMBL4053167 0.98 HSP90AA1 (0.56) HSP90AA1HSD17B10ALDH1A1MEN1CYP1A2
SCHEMBL3338535 0.91 HSP90AA1 (0.50) HSP90AA1HSD17B10ALDH1A1MEN1CYP1A2
SCHEMBL3403218 0.91 SMN1; SMN2 (0.52) HSP90AA1HSD17B10ALDH1A1MEN1CYP1A2
SCHEMBL30610947 0.87 CYP11B1 (0.48) HSP90AA1ALDH1A1MEN1CYP1A2CYP3A4
SCHEMBL1507873 0.87 CYP11B1 (0.48) HSP90AA1ALDH1A1MEN1CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL1507947 0.85 CYP11B1 (0.47) HSP90AA1ALDH1A1MEN1CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL1043466 0.85 HSP90AA1 (0.49) HSP90AA1ALDH1A1OPRD1HSP90AB1HSP90B1
SCHEMBL955143 0.85 HSP90AA1 (0.57) HSP90AA1HSD17B10ALDH1A1MEN1CYP1A2
SCHEMBL28324558 0.85 HSP90AA1 (0.54) HSP90AA1ALDH1A1OPRK1HSP90AB1HSP90B1
SCHEMBL9248339 0.84 HSP90AA1 (0.56) HSP90AA1HSD17B10ALDH1A1MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116034089-A EMM-58 zeolite compositions, synthesis and uses 埃克森美孚技术与工程公司 2023-04-28 CN claimed
US-4411700-A AMIDINE DERIVATIVES FUJI PHOTO FILM CO., LTD. (JP) 1983-10-25 US claimed
JP-7109261-A None JP disclosed
US-11793742-B2 Mixtures of cosmetic UV absorbers BASF SE (DE) 2023-10-24 US disclosed
CN-116034089-A EMM-58 zeolite compositions, synthesis and uses 埃克森美孚技术与工程公司 2023-04-28 CN disclosed
CN-112041713-A Composition for forming cured film, alignment material, and phase difference material 日产化学株式会社 2020-12-04 CN disclosed
CN-108794471-B Synthesis method of benzimidazole compound and agricultural biological activity thereof 青岛农业大学 2020-04-28 CN disclosed
US-20190008306-A1 COMPOUND, COMPOSITION, AND METHOD FOR PROTECTING SKIN FROM HIGH ENERGY VISIBLE LIGHT PHOTOPROTECTIVE TECH INC (US) 2019-01-10 US disclosed
WO-2017173214-A1 SUNSCREEN COMPOSITIONS, HEAT-PROTECTIVE COMPOSITIONS, AND METHODS OF USE L'OREAL (FR) 2017-10-05 WO disclosed
US-9764169-B2 UV filter combinations comprising benzylidene malonates BASF SE (DE) 2017-09-19 US disclosed
US-9707417-B2 Use of benzotropolone derivatives as UV absorbers and antioxidants and their use in sunscreens and/or cosmetic compositions BASF SE (DE) 2017-07-18 US disclosed
US-7588702-B2 Method of quenching electronic excitation of chromophore-containing organic molecules in photoactive compositions HALLSTAR INNOVATIONS CORP. (US) 2009-09-15 US disclosed
WO-2009108125-A1 GOLD NANOPARTICLES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-09-03 WO disclosed
US-20090074687-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS HALLSTAR INNOVATIONS CORP. (US) 2009-03-19 US disclosed
US-20090041847-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS HALLSTAR INNOVATIONS CORP. (US) 2009-02-12 US disclosed
US-20090039322-A1 Alkoxy polyester compounds, compositions and methods of use thereof HALLSTAR INNOVATIONS CORP. (US) 2009-02-12 US disclosed
US-20090039323-A1 Method of quenching electronic excitation of chromophore-containing organic molecules in photoactive compositions HALLSTAR INNOVATIONS CORP. (US) 2009-02-12 US disclosed
US-20090042312-A1 Test method for determining compounds capable of quenching electronic singlet state excitation of photoactive compounds HALLSTAR INNOVATIONS CORP. (US) 2009-02-12 US disclosed
JP-H07109261-A 1-BENSYLIMIDAZOLE COMPOUND AND EPOXY RESIN CURING AGENT SHIKOKU CHEM CORP 1995-04-25 JP disclosed
US-4411700-A AMIDINE DERIVATIVES FUJI PHOTO FILM CO., LTD. (JP) 1983-10-25 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 (5 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-20090039323-A1 Method of quenching electronic excitation of chromophore-containing organic molecules in photoactive compositions CRYAA, CRY2, CRY1 HSP90AA1 3961/4885HSD17B10 671/4885ALDH1A1 476/4885
US-20090041847-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS C1S, CBR3, C9 HSP90AA1 4445/4885HSD17B10 700/4885ALDH1A1 348/4885
US-11793742-B2 Mixtures of cosmetic UV absorbers BTD, TMSB10, TH HSP90AA1 603/4885HSD17B10 882/4885ALDH1A1 734/4885
US-20090074687-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS CRYAA, CRY2, CRYAB HSP90AA1 3949/4885HSD17B10 696/4885ALDH1A1 564/4885
US-20090039322-A1 Alkoxy polyester compounds, compositions and methods of use thereof C9, C5, HCCS HSP90AA1 3834/4885HSD17B10 76/4885ALDH1A1 537/4885

“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.