SCHEMBL26105644

SCHEMBL26105644

O=CC=CN1CCN(c2nccnc2Oc2ccc(OC(F)(F)F)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 7/20 0.41
▸ TRPV1 Q8NER1 1/20 0.37

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
SCHEMBL26105650 0.90 PDE10A (0.42) PDE10ATRPV1
SCHEMBL26107722 0.85 HRH4 (0.44) PDE10A
SCHEMBL26106840 0.84 PDE10A (0.41) PDE10A
SCHEMBL26103135 0.84 PDE10A (0.41) PDE10ATRPV1
SCHEMBL26108503 0.84 PDE10A (0.37) PDE10ATRPV1
SCHEMBL26107346 0.83 DHODH (0.44) TRPV1
SCHEMBL26108261 0.82 PDE10A (0.35) PDE10A
SCHEMBL26135830 0.78 BTK (0.45) PDE10ATRPV1
SCHEMBL30591705 0.78 BTK (0.45) PDE10ATRPV1
SCHEMBL26104579 0.78 MAPT (0.41) TRPV1

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-2023183768-A2 SMALL MOLECULE INHIBITORS OF TEA DOMAIN FAMILY MEMBERS THE SCRIPPS RESEARCH INSTITUTE (US) 2023-09-28 — — WO disclosed
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