SCHEMBL2146152

SCHEMBL2146152

[CH2]CCSC(C=C)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
ALOX15 P16050 2/20 0.32
HSD17B10 Q99714 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTR2A P28223 1/20 0.31
TAAR1 Q96RJ0 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
SCHEMBL11424799 0.83 CYP2C19 (0.37) CYP2C19CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL10973208 0.78 CYSLTR2 (0.40) HTR2A
SCHEMBL4200755 0.77 SMN1; SMN2 (0.42) CYP2C19CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL9301725 0.76 CYP1A2 (0.35) CYP2C19CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL9153275 0.76 RIPK1 (0.33) CYP2C19CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL9067800 0.76 CYP2C19 (0.37) CYP2C19CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL7959062 0.75 SLC6A3 (0.63) CYP2C19CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL776296 0.74 CYP2C19 (0.36) CYP2C19CYP3A4TSHRKDM4EALDH1A1
SCHEMBL776368 0.74 CYP2C19 (0.36) CYP2C19CYP3A4CYP2D6TSHRKDM4E
SCHEMBL11520655 0.74 LMNA (0.42) CYP2C19KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2521752-B1 ORGANOPOLYSILOXANES CONTAINING AN UNSATURATED GROUP DOW CORNING (US) 2017-10-25 EP disclosed
US-9493615-B2 Organopolysiloxanes containing an unsaturated group DOW CORNING CORPORATION (US) 2016-11-15 US disclosed
EP-2521742-A1 POLYOLEFINS MODIFIED BY SILICONES Dow Corning Corporation (US) 2012-11-14 EP disclosed
EP-2521752-A1 ORGANOPOLYSILOXANES CONTAINING AN UNSATURATED GROUP Dow Corning Corporation (US) 2012-11-14 EP disclosed
US-20120283362-A1 ORGANOPOLYSILOXANES CONTAINING AN UNSATURATED GROUP DOW SILICONES CORPORATION 2012-11-08 US disclosed
US-20120283388-A1 POLYOLEFINS MODIFIED BY SILICONES DOW CORNING EUROPE SA (BE) 2012-11-08 US disclosed
WO-2011083043-A1 POLYOLEFINS MODIFIED BY SILICONES DOW CORNING CORPORATION (US) 2011-07-14 WO disclosed
WO-2011083044-A1 ORGANOPOLYSILOXANES CONTAINING AN UNSATURATED GROUP DOW CORNING CORPORATION (US) 2011-07-14 WO disclosed
WO-2011083049-A1 ORGANOPOLYSILOXANES CONTAINING AN UNSATURATED GROUP DOW CORNING CORPORATION (US) 2011-07-14 WO disclosed
WO-2011083048-A1 DIENE ELASTOMERS MODIFIED BY SILICONES DOW CORNING CORPORATION (US) 2011-07-14 WO disclosed