SCHEMBL25131

SCHEMBL25131

[c]1cc2ccccc2c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
HSD17B10 Q99714 5/20 0.46
CYP2A6 P11509 4/20 0.46
TSHR P16473 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
HPRT1 P00492 2/20 0.42
HIF1A Q16665 2/20 0.39
CYP1B1 Q16678 1/20 0.39
MAPT P10636 1/20 0.35
PAX8 Q06710 1/20 0.34
TRPM4 Q8TD43 1/20 0.34
CYP1A2 P05177 4/20 0.33
HPGD P15428 3/20 0.33
ALOX12 P18054 1/20 0.33
HTR2A P28223 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GPR3 P46089 1/20 0.33
NQO2 P16083 1/20 0.33
THRB P10828 1/20 0.33
CYP3A4 P08684 1/20 0.32

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
SCHEMBL27616289 0.98 ALDH1A1 (0.43) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL27339348 0.91 ALDH1A1 (0.39) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL2409179 0.85 ALDH1A1 (0.37) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL2452867 0.83 ALDH1A1 (0.61) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL7414230 0.82 CA1 (0.37) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL70329 0.82 ALDH1A1 (0.43) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL234963 0.82 HPRT1 (0.58) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL235409 0.82 HPRT1 (0.58) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL1067479 0.82 ALDH1A1 (0.54) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL578709 0.81 CYP2A6 (0.32) ALDH1A1HSD17B10CYP2A6TSHRTDP1

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

Appears in 9722 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12041848-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2024-07-16 US claimed
CN-118284595-A Arylamine compound, organic electroluminescent element, and electronic device 保土谷化学工业株式会社 2024-07-02 CN claimed
CN-117820316-B Chiral indolo-dihydropyridoindole compound and synthesis method thereof 江苏师范大学 2024-06-28 CN claimed
US-20240208991-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD (KR) 2024-06-27 US claimed
EP-4387978-A1 7-SUBSTITUTED 7-DEAZAADENINE-CONTAINING 2',3'-CYCLIC DINUCLEOTIDES Ustav Organicke Chemie a Biochemie AV CR, v.v.i. (CZ) 2024-06-26 EP claimed
US-12018122-B2 Method for producing silane-modified polymers MERZ+BENTELI AG (CH) 2024-06-25 US claimed
CN-114423739-B Improved enantioselective hydrogenation of 4-substituted 1, 2-dihydroquinolines in the presence of chiral iridium catalysts and additives 拜耳公司 2024-06-25 CN claimed
CN-110277500-B Organic light emitting device 三星显示有限公司 2024-06-21 CN claimed
WO-2024122532-A1 THERMOPLASTIC RESIN AND MOLDED OBJECT INCLUDING THERMOPLASTIC RESIN 三菱瓦斯化学株式会社 2024-06-13 WO claimed
CN-118084763-A Multiple chiral element 2-vinyl indole compound and synthesis method thereof 江苏师范大学 2024-05-28 CN claimed
WO-1991017987-A1 PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1991-11-28 WO claimed
WO-1991015206-A1 TREATMENT OF GLAUCOMA AND OCULAR HYPERTENSION WITH IMIDAZOLE ANGIOTENSIN-II RECEPTOR ANTAGONISTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-10-17 WO claimed
WO-1991014367-A1 TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS WITH IMIDAZOLE ANGIOTENSIN-II RECEPTOR ANTAGONISTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-10-03 WO claimed
WO-1991000281-A2 FUSED-RING ARYL SUBSTITUTED IMIDAZOLES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-10 WO claimed
US-4808625-A ANTITUMOR AGENTS BURROUGHS WELLCOME CO. (US) 1989-02-28 US claimed
EP-0125701-B1 POLYCYCLIC AROMATIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1988-08-03 EP claimed
EP-0125701-A2 Polycyclic aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1984-11-21 EP claimed
EP-0012611-A2 Electrophotographic element Ricoh Company, Ltd (JP) 1980-06-25 EP claimed
US-3993645-A Stilbene optical brighteners and compositions brightened therewith STERLING DRUG INC. (US) 1976-11-23 US claimed
US-3932301-A NYLON, POLYESTERS STERLING DRUG INC. (US) 1976-01-13 US claimed