SCHEMBL458268

SCHEMBL458268

Cc1cc(C)cc(Oc2cc(C)cc(C)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
TSHR P16473 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
CYP3A4 P08684 1/20 0.57
MAPK1 P28482 1/20 0.57
POLB P06746 2/20 0.48
CYP2C9 P11712 1/20 0.48
NPSR1 Q6W5P4 1/20 0.45
TEAD4 Q15561 1/20 0.43
MAPT P10636 3/20 0.42
HPGD P15428 1/20 0.41
ACHE P22303 2/20 0.38
PTPN1 P18031 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL12378007 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL29378528 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
Phosphine SCHEMBL22361930 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL13317292 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL9352887 0.91 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL5608812 0.86 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL7188789 0.86 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL2672668 0.84 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL16186449 0.84 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL16186446 0.84 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114031639-A Preparation method of biphosphonate with P-O-C-P structure 烟台大学 2022-02-11 CN claimed
CN-103582690-B A kind of method of preparing core-shell nano and solution thereof BAYER TECHNOLOGY AND ENGINEERING (SHANGHAI) Co.,Ltd. (CN) 2016-05-25 CN claimed
CN-105358238-A Multi-channel membrane BASF SE 2016-02-24 CN claimed
CN-103582690-A Preparation methods of core-shell nanoparticles and solution thereof BAYER TECHNOLOGY AND ENGINEERING SHANGHAI CO LTD 2014-02-12 CN claimed
US-7741240-B2 Transition metal compounds for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-06-22 US claimed
EP-1753773-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION ExxonMobil Chemical Patents Inc. (US) 2007-02-21 EP claimed
WO-2005118605-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2005-12-15 WO claimed
CN-114031639-B Preparation method of biphospide with P-O-C-P structure 烟台大学 2024-07-12 CN disclosed
US-11839140-B2 Metal complexes comprising diazabenzmidazolocarbene ligands and the use thereof in OLEDS UDC IRELAND LIMITED (IE) 2023-12-05 US disclosed
US-11765967-B2 Highly efficient OLED devices with very short decay times UDC IRELAND LIMITED (IE) 2023-09-19 US disclosed
CN-111606945-B Preparation method of compound containing P-O bond or P-S bond 烟台大学 2023-06-20 CN disclosed
CN-109863223-B Preparation of organic functional material 默克专利有限公司 2023-06-20 CN disclosed
US-20230026258-A1 Metal Complexes Comprising Diazabenzmidazolocarbene Ligands and the Use Thereof in OLEDS UDC IRELAND LTD (IE) 2023-01-26 US disclosed
EP-0317208-A2 Preparation of Diaryl Ethers and Diaryl Sulfides AMOCO CORPORATION (US) 1989-05-24 EP disclosed
EP-0135938-B1 PROCESS FOR PRODUCING AROMATIC POLYETHER KETONES AND POLYTHIOETHER KETONES MITSUBISHI KASEI CORPORATION (JP) 1988-06-22 EP disclosed
US-4707536-A Catalytic preparation of aromatic polyketone from phosgene and aromatic ether or sulfide MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1987-11-17 US disclosed
US-4661581-A REACTING AROMATIC ETHERS OR THIOETHERS WITH PHOSGENE IN AN APROTIC SOLVENT WITH GROUP 3 METAL HALIDE CATALYST MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) 1987-04-28 US disclosed
EP-0135938-A2 Process for producing aromatic polyether ketones and polythioether ketones MITSUBISHI KASEI CORPORATION (JP) 1985-04-03 EP disclosed
US-4271035-A CONTAINING A POLYALKYLENE GLYCOL DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1981-06-02 US disclosed
EP-0008735-A1 Process for the preparation of diphenyl ether carboxylic acids BAYER AG (DE) 1980-03-19 EP 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 (2 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-20230026258-A1 Metal Complexes Comprising Diazabenzmidazolocarbene Ligands and the Use Thereof in OLEDS OCIAD1, OCIAD2, DRD2 ALDH1A1 2588/4885SMN1; SMN2 3047/4885TSHR 1713/4885
US-11839140-B2 Metal complexes comprising diazabenzmidazolocarbene ligands and the use thereof in OLEDS OCIAD1, OCIAD2, DRD2 ALDH1A1 2588/4885SMN1; SMN2 3047/4885TSHR 1713/4885

“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.