SCHEMBL2493378

SCHEMBL2493378

CCCO[Si](C1CCCC1)(C1CCCC1)C1CCCC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL2493181 0.86 CYP1A2 (0.37) CYP1A2
SCHEMBL105106 0.86 CYP1A2 (0.31) CYP1A2CYP2D6CYP2C19
SCHEMBL1313844 0.85 CYP1A2 (0.40) CYP1A2
SCHEMBL104165 0.84 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C19
SCHEMBL106200 0.84 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C19
SCHEMBL105137 0.81
SCHEMBL106307 0.81 CYP1A2 (0.31) CYP1A2CYP2D6CYP2C19
SCHEMBL1561932 0.80
SCHEMBL108546 0.79 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C19
SCHEMBL106099 0.79 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C19

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-8030429-B2 Catalyst for dealcoholization condensation reaction and method for producing organopolysiloxane using the same DOW CORNING TORAY COMPANY, LTD. (JP) 2011-10-04 US disclosed
US-20100063236-A1 Catalyst for Dealcoholization Condensation Reaction and Method for Producing Organopolysiloxane Using the Same DOW CORNING TORAY CO., LTD. (JP) 2010-03-11 US disclosed
EP-2116563-A1 CATALYST FOR DEALCOHOLIZATION CONDENSATION REACTION AND METHOD FOR PRODUCING ORGANOPOLYSILOXANE USING THE SAME Dow Corning Toray Co., Ltd. (JP) 2009-11-11 EP disclosed