SCHEMBL19640254

SCHEMBL19640254

CCO[Si](C)(CCCSC(C)=O)OCC

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.35
POLB P06746 1/20 0.34
BLM P54132 1/20 0.34
ATM Q13315 1/20 0.34
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC10 Q969S8 1/20 0.30
HDAC11 Q96DB2 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
HDAC9 Q9UKV0 1/20 0.30
HDAC5 Q9UQL6 1/20 0.30

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
SCHEMBL19640265 0.89 CYP2C19 (0.38) CYP2C19POLBBLMATM
SCHEMBL2489854 0.85 CYP2C19 (0.35) CYP2C19POLBBLMATMHDAC3
SCHEMBL2616700 0.84 NOS3 (0.31)
SCHEMBL3680780 0.83 CYP2C19 (0.36) CYP2C19POLBBLMATMHDAC3
SCHEMBL29211227 0.81 CYP2C19 (0.38) CYP2C19POLBBLMATMHDAC3
SCHEMBL29211203 0.79 CYP2C19 (0.36) CYP2C19POLBBLMATMHDAC3
SCHEMBL19640253 0.79 ALDH1A1 (0.30)
SCHEMBL15305871 0.78 CES2 (0.37) HDAC11
SCHEMBL29488592 0.77 CYP2C19 (0.32) CYP2C19POLBBLMATM
SCHEMBL28065159 0.77 CYP2C19 (0.38) CYP2C19POLBBLMATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10246581-B2 Rubber compositions containing whey protein BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) 2019-04-02 US disclosed
US-20170342253-A1 RUBBER COMPOSITIONS CONTAINING WHEY PROTEIN BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC 2017-11-30 US disclosed
CN-101880415-B Silica-rubber mixtures having improved hardness MOMENTIVE PERFORMANCE MAT INC (US) 2013-05-22 CN disclosed
CN-1681876-B Silica-rubber mixtures with improved hardness MOMENTIVE PERFORMANCE MAT INC (US) 2012-05-30 CN disclosed
CN-1681876-A Silica-rubber mixtures with improved hardness GEN ELECTRIC (US) 2005-10-12 CN disclosed