SCHEMBL22394306

SCHEMBL22394306

OC[C@H](NCCNC(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(C(F)(F)F)cc2)nc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPV3 Q8NET8 14/20 0.46
▸ FAAH O00519 1/20 0.39
▸ MTOR P42345 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ GRM7 Q14831 1/20 0.38
▸ SCN9A Q15858 3/20 0.38
▸ CTSA P10619 1/20 0.38

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
SCHEMBL22394308 0.84 TRPV3 (0.48) TRPV3SCN9A
SCHEMBL22321561 0.83 FAAH (0.44) TRPV3FAAHMTORRAB9AGRM7
SCHEMBL22321563 0.83 FAAH (0.44) TRPV3FAAHMTORRAB9AGRM7
SCHEMBL22321590 0.83 FAAH (0.44) TRPV3FAAHMTORRAB9AGRM7
SCHEMBL22394320 0.83 TRPV3 (0.47) TRPV3
SCHEMBL22337628 0.82 FAAH (0.37) TRPV3FAAHMTORRAB9AGRM7
SCHEMBL22394319 0.82 TRPV3 (0.47) TRPV3SCN9A
SCHEMBL22394304 0.82 TRPV3 (0.43) TRPV3SCN9A
SCHEMBL22337298 0.81 TRPV3 (0.39) TRPV3FAAHMTORRAB9AGRM7
SCHEMBL22394311 0.81 TRPV3 (0.46) TRPV3SCN9A

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
EP-3704093-A1 NOVEL AMINOPYRIDINEMETHANOL COMPOUNDS AND THEIR USE Université Amiens Picardie Jules Verne (FR) 2020-09-09 — — EP claimed
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