SCHEMBL4923762

SCHEMBL4923762

CC(C[Si](C)(Cl)Cl)c1cccc(C(C)(C)Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.34
KIF11 P52732 2/20 0.33
RIPK1 Q13546 1/20 0.32
DAO P14920 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL3637787 0.90 KIF11 (0.36) PNMTKIF11RIPK1HDAC4HDAC2
SCHEMBL20963009 0.77 KIF11 (0.46) PNMTKIF11DAOHDAC4HDAC2
SCHEMBL4923756 0.75 KIF11 (0.32) KIF11RIPK1
SCHEMBL1599405 0.75 TAAR1 (0.50) RIPK1ALDH1A1
SCHEMBL9776758 0.73 AOC3 (0.34)
SCHEMBL45022 0.70 ESR1 (0.44) KIF11HDAC4HDAC2HDAC8ALDH1A1
SCHEMBL28391583 0.69 HDAC4 (0.38) PNMTKIF11RIPK1HDAC4HDAC2
SCHEMBL12110561 0.68 PNMT (0.33) PNMT
SCHEMBL28107086 0.67 HDAC4 (0.50) KIF11RIPK1HDAC4HDAC2HDAC8
SCHEMBL5485069 0.67 HDAC4 (0.39) KIF11HDAC4HDAC2HDAC8ALDH1A1

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-20080125549-A1 COUPLING OF LIVING CARBOCATIONIC POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2008-05-29 US disclosed
US-6469115-B1 ROOM TEMPERATURE VULCANIZABLE POLYISOBUTYLENE POLYMER HAVING HYDROLYZABLE SILYL- FUNCTIONAL GROUPS POSITIONED AT OR NEAR MOLECULAR CHAIN ENDS DOW CORNING CORPORATION 2002-10-22 US disclosed
WO-2001087999-A2 VIRTUALLY TELECHELIC SILYL-FUNCTIONAL POLYISOBUTYLENE DOW CORNING CORPORATION (US) 2001-11-22 WO disclosed