SCHEMBL27850485

SCHEMBL27850485

O=C(O)N1CC=C(c2nccnc2Oc2ccc(Nc3nc4ccccc4s3)c(F)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 18/20 0.54
▸ TRPV1 Q8NER1 1/20 0.43

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
SCHEMBL1304580 0.90 PDE10A (0.65) PDE10ATRPV1
SCHEMBL11989068 0.83 PDE10A (0.59) PDE10A
SCHEMBL1303346 0.80 PDE10A (0.53) PDE10A
SCHEMBL7939118 0.79 PDE10A (0.46) PDE10A
SCHEMBL11989136 0.79 PDE10A (0.46) PDE10A
SCHEMBL1303691 0.79 PDE10A (0.46) PDE10A
SCHEMBL13474538 0.77 PDE10A (0.82) PDE10A
SCHEMBL14799404 0.77 PDE10A (0.86) PDE10A
SCHEMBL1304144 0.77 PDE10A (0.61) PDE10A
SCHEMBL2641675 0.75 PDE10A (0.61) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102300860-A Pyrazine compounds as phosphodiesterase 10 inhibitors — 2011-12-28 — — CN claimed
CN-102300860-A Pyrazine compounds as phosphodiesterase 10 inhibitors — 2011-12-28 — — CN disclosed
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