SCHEMBL29888333

SCHEMBL29888333

CN1CCCC(C(=O)NNC(=O)c2ccccc2Nc2ccc(C(F)(F)F)cc2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 10/20 0.48
▸ SMO Q99835 3/20 0.39
▸ CHRM3 P20309 1/20 0.38
▸ FPR2 P25090 4/20 0.38
▸ FPR1 P21462 1/20 0.37
▸ ABCG2 Q9UNQ0 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
SCHEMBL23701612 0.79 RXFP1 (0.50) RXFP1SMOABCG2
SCHEMBL30323348 0.78 PRKAB2 (0.45) RXFP1SMOABCG2
SCHEMBL22571443 0.77 GAA (0.57) RXFP1
SCHEMBL22556375 0.76 MEN1 (0.55) RXFP1
SCHEMBL30463745 0.76 MEN1 (0.55) RXFP1
SCHEMBL22556334 0.76 RXFP1 (0.53) RXFP1ABCG2
SCHEMBL22556320 0.75 RXFP1 (0.53) RXFP1SMO
SCHEMBL23701602 0.75 RXFP1 (0.53) RXFP1SMO
SCHEMBL23713156 0.73 RXFP1 (0.47) RXFP1ABCG2
SCHEMBL22571408 0.73 RXFP1 (0.50) RXFP1ABCG2

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-4061364-A1 HETEROARYL COMPOUNDS Vivace Therapeutics, Inc. (US) 2022-09-28 — — EP disclosed
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