SCHEMBL4010759

SCHEMBL4010759

O=C(O)N1CC=C(c2cccnc2Oc2cccc(C(F)(F)F)c2Cl)CC1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.43
PDE10A Q9Y233 3/20 0.42
P2RX7 Q99572 7/20 0.39

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
SCHEMBL4010869 0.91 PDE10A (0.46) TRPV1PDE10A
SCHEMBL13770042 0.89 PDE10A (0.53) PDE10A
SCHEMBL4017987 0.88 PDE10A (0.45) TRPV1PDE10A
SCHEMBL4007141 0.80 PDE10A (0.42) TRPV1PDE10A
SCHEMBL4015332 0.80 PDE10A (0.51) PDE10A
SCHEMBL4006732 0.80 PDE10A (0.49) PDE10A
SCHEMBL4008377 0.80 PDE10A (0.58) PDE10A
SCHEMBL4014482 0.79 PDE10A (0.44) TRPV1PDE10A
SCHEMBL4555950 0.79 PDE10A (0.44) TRPV1PDE10A
SCHEMBL4011858 0.79 PDE10A (0.44) 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-2009081259-A1 PHENOXY-PYRIDYL DERIVATIVES PFIZER INC. (US) 2009-07-02 WO disclosed