SCHEMBL723565

SCHEMBL723565

Cc1ccsc1-c1sccc1-c1cccs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.40
CYP2E1 P05181 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2B6 P20813 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LTA4H P09960 1/20 0.39
NPC1 O15118 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAPK1 P28482 1/20 0.37
PTPRC P08575 1/20 0.37
MAPT P10636 4/20 0.37
GAA P10253 2/20 0.37
KEAP1 Q14145 1/20 0.37
HPGD P15428 2/20 0.37

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
SCHEMBL4586854 0.85 CYP2A6 (0.40) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9
SCHEMBL723960 0.84 CYP2A6 (0.44) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9
SCHEMBL4585879 0.83 PTPRC (0.40) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9
Benzene SCHEMBL28459864 0.82 CYP2A6 (0.43) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9
SCHEMBL365802 0.81 KDM4E (0.42) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9
SCHEMBL147273 0.81 KDM4E (0.42) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9
Methyl Alcohol SCHEMBL6013731 0.80 ALDH1A1 (0.42) ALDH1A1KDM4ERAB9ALTA4HNPC1
SCHEMBL22734821 0.80 MAPT (0.35) ALDH1A1KDM4ERAB9ASMN1; SMN2LTA4H
SCHEMBL22734772 0.78 PTPRC (0.41) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9
SCHEMBL22763310 0.78 PTPRC (0.41) CYP2A6CYP2E1CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080171211-A1 Using electrically conductive polymer which during change in potential releases anions which inhibit the anodic or/and cathodic partial reaction of corrosion or/and releases adhesion-promoting anions CHEMETALL GMBH (DE) 2008-07-17 US claimed
US-20120208086-A1 PROCESS FOR COATING FINE PARTICLES WITH CONDUCTIVE POLYMERS DEFENSE THREAT REDUCTION AGENCY; DEPT. OF DEFENSE; UNITED STATES GOVERNMENT 2012-08-16 US disclosed
US-20120052307-A1 PROCESS FOR COATING METALLIC SURFACES WITH AN ANTI-CORROSIVE COATING PLIETH WALDFRIED (DE) 2012-03-01 US disclosed
US-20080305341-A1 Process for Coating Metallic Surfaces With an Anti-Corrosive Coating CHEMETALL GMBH (DE) 2008-12-11 US disclosed
US-20080175992-A1 Process For Coating Fine Particles With Conductive Polymers CHEMETALL GMBH (DE) 2008-07-24 US disclosed
US-20080171211-A1 Using electrically conductive polymer which during change in potential releases anions which inhibit the anodic or/and cathodic partial reaction of corrosion or/and releases adhesion-promoting anions CHEMETALL GMBH (DE) 2008-07-17 US disclosed