SCHEMBL8235115

SCHEMBL8235115

Bc1cnnc2cc(CC)c(OC)cc12

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 15/20 0.44
TAAR1 Q96RJ0 2/20 0.39
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
EHMT2 Q96KQ7 1/20 0.34
EHMT1 Q9H9B1 1/20 0.34

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
SCHEMBL4164752 0.82 PDE10A (0.44) PDE10ATAAR1CYP1A2CYP3A4CYP2C19
SCHEMBL4165792 0.82 PDE10A (0.44) PDE10ATAAR1CYP1A2CYP3A4CYP2C19
SCHEMBL4167893 0.76 PDE10A (0.44) PDE10ATAAR1CYP1A2CYP3A4CYP2C19
SCHEMBL4155866 0.76 PDE10A (0.44) PDE10ATAAR1CYP1A2CYP3A4CYP2C19
SCHEMBL8078229 0.72 PDE10A (0.43) PDE10A
SCHEMBL8230235 0.69 ADRA1D (0.43) PDE10AEHMT2EHMT1
SCHEMBL4173265 0.69 ADRA1D (0.46) PDE10A
SCHEMBL4778181 0.68 KDR (0.40) PDE10A
SCHEMBL2949402 0.68 TAAR1 (0.71) TAAR1CYP3A4
SCHEMBL24391836 0.67 HTR1A (0.41) PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007100880-A1 CINNOLINE AND QUINAZOLINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-09-07 WO disclosed