SCHEMBL8622874

SCHEMBL8622874

OCc1cccc2ccc3ccccc3c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.50
HSD17B10 Q99714 5/20 0.50
HPGD P15428 4/20 0.50
ALDH1A1 P00352 3/20 0.50
THRB P10828 1/20 0.50
TDP1 Q9NUW8 2/20 0.47
CYP2C19 P33261 3/20 0.47
CYP2C9 P11712 2/20 0.47
TSHR P16473 3/20 0.46
CYP2A6 P11509 1/20 0.46
ACP3 P15309 1/20 0.46
CYP2D6 P10635 1/20 0.44
HPRT1 P00492 1/20 0.42
CYP3A4 P08684 2/20 0.42
HTT P42858 1/20 0.42
CYP1A1 P04798 1/20 0.42
CYP1B1 Q16678 1/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL3407527 0.84 CYP1A2 (0.48) CYP1A2HSD17B10HPGDALDH1A1THRB
SCHEMBL29384962 0.84 CYP1A2 (0.45) CYP1A2HSD17B10HPGDALDH1A1THRB
SCHEMBL27015 0.84 CYP1A2 (0.45) CYP1A2HSD17B10HPGDALDH1A1THRB
Naphthalen-1-Yl-Methanol SCHEMBL28403 0.81 CYP1A2 (0.60) CYP1A2HSD17B10HPGDALDH1A1TDP1
SCHEMBL9976120 0.81 ALDH1A1 (0.48) CYP1A2HSD17B10HPGDALDH1A1THRB
SCHEMBL1971149 0.81 CYP1A2 (0.48) CYP1A2HSD17B10HPGDALDH1A1THRB
SCHEMBL27201705 0.81 CYP1A2 (0.52) CYP1A2HSD17B10HPGDALDH1A1THRB
Naphthalen-1-Yl-Methanol SCHEMBL27446769 0.79 CYP1A2 (0.58) CYP1A2HSD17B10HPGDALDH1A1TDP1
SCHEMBL23781282 0.79 CYP1A2 (0.64) CYP1A2HSD17B10HPGDALDH1A1THRB
SCHEMBL27498191 0.79 TDP1 (0.73) CYP1A2HSD17B10HPGDALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970811-B1 VISCOSITY IMPROVER GRAFTED WITH UNSATURATED ACYLATING AGENT AND A POLYAROMATIC HYDROCARBON CHEVRON ORONITE CO (US) 2017-01-25 EP disclosed
EP-2970811-A2 VISCOSITY IMPROVER GRAFTED WITH UNSATURATED ACYLATING AGENT AND A POLYAROMATIC HYDROCARBON Chevron Oronite Company LLC (US) 2016-01-20 EP disclosed
US-9234153-B2 Viscosity improver grafted with unsaturated acylating agent and a polyaromatic hydrocarbon CHEVRON ORONITE COMPANY LLC (US) 2016-01-12 US disclosed
CN-104903432-A Viscosity improver grafted with unsaturated acylating agent and polyaromatic hydrocarbon CHEVRON ORONITE CO 2015-09-09 CN disclosed
WO-2014149086-A2 VISCOSITY IMPROVER GRAFTED WITH UNSATURATED ACYLATING AGENT AND A POLYAROMATIC HYDROCARBON CHEVRON ORONITE COMPANY LLC (US) 2014-09-25 WO disclosed
US-20140274842-A1 VISCOSITY IMPROVER GRAFTED WITH UNSATURATED ACYLATING AGENT AND A POLYAROMATIC HYDROCARBON CHEVRON ORONITE COMPANY LLC (US) 2014-09-18 US disclosed
US-5780250-A Immunoassay standards for polyaromatic hydrocarbon detection STRATEGIC DIAGNOSTICS, INC. (US) 1998-07-14 US disclosed
WO-1997031267-A1 IMMUNOASSAY STANDARDS FOR POLYAROMATIC HYDROCARBON DETECTION STRATEGIC DIAGNOSTICS, INC. (US) 1997-08-28 WO disclosed
US-4808625-A ANTITUMOR AGENTS BURROUGHS WELLCOME CO. (US) 1989-02-28 US disclosed
EP-0125701-B1 POLYCYCLIC AROMATIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1988-08-03 EP disclosed
US-4719055-A ANTITUMOR BURROUGHS WELLCOME CO. (US) 1988-01-12 US disclosed
EP-0125701-A2 Polycyclic aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1984-11-21 EP disclosed