SCHEMBL818978

SCHEMBL818978

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.41
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
CES1 P23141 1/20 0.38
ALDH1A1 P00352 4/20 0.36
CYP1A2 P05177 1/20 0.36
ALOX15 P16050 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36

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
SCHEMBL820212 0.84 CYP2C19 (0.39) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL28402923 0.79 CYP2C19 (0.43) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL818203 0.72 CYP1A2 (0.41) KCNN4CYP2C19HIF1AKMT2ACES1
SCHEMBL6372896 0.72 KCNN4 (0.46) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL6372894 0.72 KCNN4 (0.46) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL6372899 0.72 KCNN4 (0.46) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL4965119 0.71 KCNN4 (0.55) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL11268748 0.70 ALDH1A1 (0.48) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL28405954 0.70 KCNN4 (0.44) KCNN4CYP2C19HIF1AKMT2AMAPT
SCHEMBL18965730 0.70 KCNN4 (0.53) KCNN4CYP2C19HIF1AKMT2AMAPT

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