SCHEMBL6693306

SCHEMBL6693306

C1C[C](CC2CCCC2)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
DAO P14920 1/20 0.38
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
TSHR P16473 1/20 0.32
RECQL P46063 1/20 0.32
CEL P19835 1/20 0.31
CHRM5 P08912 2/20 0.31
CYP1A2 P05177 1/20 0.31
ADRA2C P18825 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 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
SCHEMBL6696059 0.94 HTR3A (0.35) HTR3AHRH4DAONOS1NOS2
SCHEMBL3155486 0.94
SCHEMBL1524762 0.91 HTR3A (0.39) HTR3AHRH4DAONOS1NOS2
SCHEMBL6585017 0.91 HTR3A (0.39) HTR3AHRH4DAONOS1NOS2
SCHEMBL15552104 0.91 HTR3A (0.39) HTR3AHRH4DAONOS1NOS2
SCHEMBL2334878 0.91 HTR3A (0.39) HTR3AHRH4DAONOS1NOS2
SCHEMBL1524741 0.91 HTR3A (0.39) HTR3AHRH4DAONOS1NOS2
SCHEMBL1057638 0.90
SCHEMBL2463395 0.88 HTR3A (0.31) HTR3AHRH4
SCHEMBL4983000 0.88

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
JP-2004523599-A 2004-08-05 JP claimed
EP-1353961-A2 (CYCLOALKYL)METHYL SILANES AS EXTERNAL DONORS FOR POLYOLEFIN CATALYSTS ENGELHARD CORPORATION (US) 2003-10-22 EP claimed
WO-2002016444-A2 (CYCLOAKYL)METHYL SILANES AS EXTERNAL DONORS FOR POLYOLEFIN CATALYSTS ENGELHARD CORPORATION (US) 2002-02-28 WO claimed