SCHEMBL20001280

SCHEMBL20001280

COc1cc(C)c([C@@H]2CC(=O)NC[C@H]2NC(N)=O)c(F)c1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 20/20 0.61
FPR2 P25090 15/20 0.61

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
SCHEMBL20001279 0.90 FPR1 (0.63) FPR1FPR2
SCHEMBL19972335 0.87 FPR1 (0.70) FPR1FPR2
SCHEMBL20001247 0.81 FPR1 (0.47) FPR1FPR2
SCHEMBL20001250 0.80 FPR1 (0.90) FPR1FPR2
SCHEMBL19988378 0.80 FPR1 (0.64) FPR1FPR2
SCHEMBL19988729 0.80 FPR1 (0.64) FPR1FPR2
SCHEMBL19988367 0.80 FPR1 (0.64) FPR1FPR2
SCHEMBL21332249 0.78 FPR1 (0.59) FPR1FPR2
SCHEMBL19972408 0.76 FPR1 (1.00) FPR1FPR2
SCHEMBL19988739 0.76 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018054549-A1 6-MEMBERED CYCLIC AMINES OR LACTAMES SUBSTITUTED WITH UREA AND PHENYL Grünenthal GmbH (DE) 2018-03-29 WO disclosed