SCHEMBL5508306

SCHEMBL5508306

NC[C@H]1CCc2sc3ccccc3c2C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.40
DRD2 P14416 1/20 0.37
DRD1 P21728 1/20 0.37
DRD4 P21917 1/20 0.37
DRD5 P21918 1/20 0.37
DRD3 P35462 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36

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
SCHEMBL4904007 1.00 PNMT (0.40) PNMTDRD2DRD1DRD4DRD5
SCHEMBL4904558 0.75 LIMK1 (0.40)
SCHEMBL4905208 0.72
SCHEMBL10748232 0.70 NR2E1 (0.66) DRD2DRD1DRD4DRD5DRD3
Ammonia Solution, Strong SCHEMBL15466738 0.69 DRD2 (0.50) PNMTDRD2DRD1DRD4DRD5
SCHEMBL4904164 0.68 PDK1 (0.46)
SCHEMBL450863 0.68 DRD2 (0.49) PNMTDRD2DRD1DRD4DRD5
SCHEMBL15595295 0.68 DRD2 (0.49) PNMTDRD2DRD1DRD4DRD5
SCHEMBL29767754 0.68 DRD2 (0.49) PNMTDRD2DRD1DRD4DRD5
SCHEMBL25424691 0.67 DRD2 (0.40) PNMTDRD2DRD1DRD4DRD5

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-1856126-A2 CYCLOALKYLFUSED INDOLE, BENZOTHIOPHENE, BENZOFURAN AND INDENE DERIVATIVES Wyeth a Corporation of the State of Delaware (US) 2007-11-21 EP claimed
WO-2006089053-A2 CYCLOALKYLFUSED INDOLE, BENZOTHIOPHENE, BENZOFURAN AND INDENE DERIVATIVES WYETH (US) 2006-08-24 WO claimed