SCHEMBL20386941

SCHEMBL20386941

CCSc1c(-c2nc3cc(C(F)(F)F)ncc3n2C)nc(C2CCCCC2)n1C

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 2/20 0.36
▸ ALOX5AP P20292 1/20 0.31
▸ MCHR1 Q99705 1/20 0.30
▸ CNR2 P34972 1/20 0.30
▸ IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL20386959 0.95 MCHR1 (0.33) MCHR1
SCHEMBL23018095 0.92 MCHR1 (0.31) MCHR1
SCHEMBL23018084 0.91 PDE1A (0.32) MCHR1
SCHEMBL23018091 0.87 CYP11B1 (0.33) CNR2
SCHEMBL23018086 0.85 GNRHR (0.31) —
SCHEMBL20386811 0.83 CNR2 (0.40) TLR7ALOX5APMCHR1CNR2
SCHEMBL25658526 0.82 POLB (0.30) —
SCHEMBL19888445 0.82 — —
SCHEMBL29574039 0.81 — —
SCHEMBL20379039 0.81 — —

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
EP-3568392-B1 IMIDAZOLE DERIVATIVES AS PEST CONTROL AGENTS BAYER AG (DE) 2021-02-24 — — EP disclosed
WO-2018130437-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2018-07-19 — — WO disclosed
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