SCHEMBL7501835

SCHEMBL7501835

Cc1c(C)c(C)c2cc3cc4ccccc4cc3cc2c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.46
CYP2A6 P11509 6/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 8/20 0.44
HSD17B10 Q99714 4/20 0.44
HIF1A Q16665 3/20 0.44
CYP3A4 P08684 2/20 0.44
CASP1 P29466 2/20 0.44
CASP7 P55210 2/20 0.44
ALOX15 P16050 1/20 0.44
HBB P68871 1/20 0.44
CYP1A2 P05177 5/20 0.42
TSHR P16473 2/20 0.42
MAPT P10636 3/20 0.42
CYP1B1 Q16678 1/20 0.42
HPGD P15428 4/20 0.40
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
RAB9A P51151 2/20 0.39
GLA P06280 2/20 0.39

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
SCHEMBL687284 1.00 NQO1 (0.46) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL1976533 0.94 CYP2A6 (0.50) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL28542519 0.92 NQO1 (0.48) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL4646013 0.90 HSD17B10 (0.50) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL4642683 0.88 CYP2A6 (0.50) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL29853846 0.88 CYP2A6 (0.50) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL27947383 0.87 CYP1A2 (0.55) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL6895452 0.85 CYP1A2 (0.35) CYP2A6CYP1A2
SCHEMBL164133 0.84 HSD17B10 (0.45) NQO1CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL29853851 0.83 HSD17B10 (0.54) NQO1CYP2A6TDP1ALDH1A1HSD17B10

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6358633-B1 ORGANIC AROMATIC COMPOUNDS AS DOPES FOR EMITTER LAYERS, HOLE INJECTION ELECTRODES SANYO ELECTRIC CO., LTD. (JP) 2002-03-19 US claimed
EP-1020510-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT Sanyo Electric Co., Ltd. (JP) 2000-07-19 EP claimed
US-6358633-B1 ORGANIC AROMATIC COMPOUNDS AS DOPES FOR EMITTER LAYERS, HOLE INJECTION ELECTRODES SANYO ELECTRIC CO., LTD. (JP) 2002-03-19 US disclosed
EP-1020510-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT Sanyo Electric Co., Ltd. (JP) 2000-07-19 EP disclosed
US-5616287-A THERMOPLASTIC POLYMER WITH A CHARGE TRANSFER COMPLEX CIBA-GEIGY CORPORATION (US) 1997-04-01 US disclosed
US-5424372-A An epoxy resin, polyepoxide or acrylate thermoplastic homo-or copolymer substituted by haloaliphatic carboxylic group is used to form an electroconductive charge transfer complex CIBA-GEIGY CORPORATION (US) 1995-06-13 US disclosed
US-5324791-A Thermoplastic homo-or copolymer containing halogneated ester side chains CIBA-GEIGY CORPORATION (US) 1994-06-28 US disclosed
US-5200113-A Molding materials, sheets, filaments, composites CIBA-GEIGY CORPORATION (US) 1993-04-06 US disclosed
CN-88101671-A Antistatic and conduct electricity polymkeric substance and moulding material 1988-10-19 CN disclosed