SCHEMBL818203

SCHEMBL818203

COCC(C(=O)Cl)(c1ccccc1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 1/20 0.41
KCNN4 O15554 1/20 0.40
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
CACNA1G O43497 2/20 0.38
TSHR P16473 1/20 0.37
KIF11 P52732 1/20 0.37
CES1 P23141 1/20 0.37
KMT2A Q03164 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
APAF1 O14727 1/20 0.35
HPGD P15428 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
HTT P42858 1/20 0.34
GRIN2D O15399 1/20 0.34

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
SCHEMBL819785 0.84 CACNA1G (0.39) CYP1A2CYP2D6KCNN4CYP2C19HIF1A
SCHEMBL888286 0.84 KCNN4 (0.51) CYP1A2CYP2D6KCNN4CYP2C19HIF1A
SCHEMBL888544 0.80 CACNA1G (0.51) CYP1A2CYP2D6KCNN4CACNA1GKMT2A
SCHEMBL818925 0.75 KCNN4 (0.38) CYP1A2CYP2D6KCNN4CYP2C19HIF1A
SCHEMBL28402923 0.75 CYP2C19 (0.43) CYP1A2KCNN4CYP2C19HIF1AKIF11
SCHEMBL4963270 0.72 KCNN4 (0.53) CYP1A2CYP2D6KCNN4CYP2C19HIF1A
SCHEMBL818978 0.72 KCNN4 (0.41) CYP1A2KCNN4CYP2C19HIF1ATSHR
SCHEMBL6758874 0.70 CYP2D6 (0.52) CYP1A2CYP2D6KCNN4CYP2C19HIF1A
SCHEMBL3726388 0.70 CYP1A2 (0.52) CYP1A2CYP2D6CYP2C19HIF1AKIF11
SCHEMBL8860513 0.70 CYP2D6 (0.50) CYP1A2CYP2D6KCNN4CYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288488-B2 Process for producing solid catalyst component for olefin polymerization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-16 US disclosed
US-20110269929-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed