SCHEMBL6688884

SCHEMBL6688884

C=C(CCC)C(=O)O[Si](C)(OCC)OCC

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL6689305 0.83 ALDH1A1 (0.32) ALDH1A1CES2CES1
SCHEMBL3394141 0.83 ALDH1A1 (0.32) ALDH1A1CES2CES1
SCHEMBL1781555 0.80 THRB (0.44) ALDH1A1
SCHEMBL19582844 0.80 ALDH1A1 (0.36) ALDH1A1CES2CES1
SCHEMBL3912037 0.76 ALDH1A1 (0.46) ALDH1A1CES2CES1
SCHEMBL27550157 0.76 ALDH1A1 (0.41) ALDH1A1
SCHEMBL1246204 0.74 ALDH1A1 (0.31) ALDH1A1CES2CES1
SCHEMBL20541768 0.74 ALDH1A1 (0.31) ALDH1A1CES2CES1
SCHEMBL909896 0.73 ALDH1A1 (0.33) ALDH1A1CES2CES1
SCHEMBL18190223 0.73 CES1 (0.35) ALDH1A1CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004078793-A1 METHOD FOR SYNTHESIS OF BRANCHED COPOLYMERS BY CONTROLLED RADICAL POLYMERISATION RHODIA CHIMIE (FR) 2004-09-16 WO claimed
WO-2004078793-A1 METHOD FOR SYNTHESIS OF BRANCHED COPOLYMERS BY CONTROLLED RADICAL POLYMERISATION RHODIA CHIMIE (FR) 2004-09-16 WO disclosed