SCHEMBL876358

SCHEMBL876358

CC=C(C)C(=O)OCCC[SiH3]

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.37
ALDH1A1 P00352 2/20 0.35
ATM Q13315 1/20 0.33
HPGD P15428 1/20 0.31
THRB P10828 1/20 0.31
CYP3A4 P08684 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
SCHEMBL3748655 0.87 TSHR (0.47) TSHRALDH1A1ATMHPGDTHRB
SCHEMBL10456655 0.87 TSHR (0.47) TSHRALDH1A1ATMHPGDTHRB
SCHEMBL27823430 0.86 ALDH1A1 (0.39) TSHRALDH1A1ATMHPGD
SCHEMBL32686846 0.85 TSHR (0.50) TSHRALDH1A1ATMCYP3A4
SCHEMBL28859093 0.82 TSHR (0.34) TSHRALDH1A1ATM
SCHEMBL2340826 0.82 THRB (0.41) TSHRALDH1A1ATMTHRB
SCHEMBL418569 0.82 THRB (0.41) TSHRALDH1A1ATMTHRB
SCHEMBL262657 0.81 ALDH1A1 (0.58) TSHRALDH1A1ATMHPGD
SCHEMBL721147 0.81 ALDH1A1 (0.58) TSHRALDH1A1ATMHPGD
SCHEMBL11207343 0.81 TSHR (0.42) TSHRALDH1A1ATMHPGDCYP3A4

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
EP-2619232-A1 CONTINUOUS FLOW POLYMERISATION PROCESS Commonwealth Scientific and Industrial Research Organisation (AU) 2013-07-31 EP disclosed
WO-2012037596-A1 CONTINUOUS FLOW POLYMERISATION PROCESS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2012-03-29 WO disclosed