SCHEMBL22650382

SCHEMBL22650382

CC(C)(C)OC(=O)NC1CCCN(c2ccc(N)c(F)c2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 18/20 0.43
FPR1 P21462 11/20 0.43
F10 P00742 2/20 0.41
F2 P00734 1/20 0.41
PRSS1 P07477 1/20 0.41

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
SCHEMBL23168555 0.90 FPR2 (0.43) FPR2FPR1F10
SCHEMBL28392694 0.89 FPR2 (0.42) FPR2FPR1F10
SCHEMBL22179666 0.89 FPR2 (0.42) FPR2FPR1F10
SCHEMBL22650379 0.87 FPR2 (0.45) FPR2FPR1F10F2PRSS1
SCHEMBL14022306 0.85 FPR2 (0.45) FPR2FPR1F10F2PRSS1
SCHEMBL23975897 0.84 POLB (0.45) FPR2FPR1F10F2PRSS1
SCHEMBL22179924 0.82 FPR2 (0.45) FPR2FPR1
SCHEMBL31347254 0.82 MCHR1 (0.46) FPR2FPR1F10
SCHEMBL23168389 0.81 FPR2 (0.56) FPR2FPR1F10F2PRSS1
SCHEMBL18963926 0.81 FPR2 (0.48) FPR2FPR1F10F2PRSS1

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-2020224568-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2020-11-12 WO disclosed