SCHEMBL21332003

SCHEMBL21332003

COc1ccc(C2CNC(=O)CC2NC(=O)Nc2ccc(Br)cc2)c(F)c1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 20/20 0.71
FPR2 P25090 12/20 0.71

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
SCHEMBL21332080 0.91 FPR1 (0.86) FPR1FPR2
SCHEMBL21331924 0.89 FPR1 (0.73) FPR1FPR2
SCHEMBL21341978 0.84 FPR1 (0.85) FPR1FPR2
SCHEMBL21332044 0.84 FPR1 (0.85) FPR1FPR2
SCHEMBL21332250 0.84 FPR1 (0.71) FPR1FPR2
SCHEMBL21341942 0.84 FPR1 (0.71) FPR1FPR2
SCHEMBL21331949 0.84 FPR1 (0.61) FPR1FPR2
SCHEMBL19972303 0.83 FPR1 (1.00) FPR1FPR2
SCHEMBL19972307 0.83 FPR1 (1.00) FPR1FPR2
SCHEMBL19988385 0.83 FPR1 (1.00) FPR1FPR2

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
WO-2019170904-A1 PIPERIDINES OR PIPERIDONES SUBSTITUTED WITH UREA AND PHENYL Grünenthal GmbH (DE) 2019-09-12 WO claimed
WO-2019170904-A1 PIPERIDINES OR PIPERIDONES SUBSTITUTED WITH UREA AND PHENYL Grünenthal GmbH (DE) 2019-09-12 WO disclosed