SCHEMBL819785

SCHEMBL819785

CCOCC(C(=O)Cl)(c1ccccc1)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
OPRM1 P35372 4/20 0.35
KCNH2 Q12809 3/20 0.35
OPRD1 P41143 3/20 0.35
GRIN2D O15399 2/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2A Q12879 2/20 0.35
GRIN2B Q13224 2/20 0.35
GRIN2C Q14957 2/20 0.35
OPRK1 P41145 2/20 0.35
MRGPRX2 Q96LB1 2/20 0.35
KIF11 P52732 1/20 0.35
CACNA1F O60840 1/20 0.35
ABCB1 P08183 1/20 0.35
CYP2B6 P20813 1/20 0.35
DRD4 P21917 1/20 0.35

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
SCHEMBL818203 0.84 CYP1A2 (0.41) CACNA1GCYP1A2CYP2D6CYP2C19HIF1A
SCHEMBL888547 0.84 CACNA1G (0.48) CACNA1GCYP1A2CYP2D6KIF11CHRM3
SCHEMBL818876 0.77 GRIN2D (0.37) CYP1A2CYP2D6CYP2C19HIF1AOPRM1
SCHEMBL820212 0.74 CYP2C19 (0.39) CYP1A2CYP2D6CYP2C19HIF1ACHRM3
SCHEMBL11842386 0.73 CACNA1G (0.52) CACNA1GCYP1A2CYP2D6CHRM3ALDH1A1
SCHEMBL3726388 0.72 CYP1A2 (0.52) CYP1A2CYP2D6CYP2C19HIF1AOPRM1
SCHEMBL888544 0.72 CACNA1G (0.51) CACNA1GCYP1A2CYP2D6CHRM3ALDH1A1
SCHEMBL29097238 0.70 KMT2A (0.42) CYP1A2CYP2D6CYP2C19HIF1ACHRM3
SCHEMBL6053202 0.70 CYP2D6 (0.39) CYP1A2CYP2D6CYP2C19HIF1AOPRM1
SCHEMBL7648277 0.70 CYP2D6 (0.39) CYP1A2CYP2D6CYP2C19HIF1AOPRM1

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