SCHEMBL856822

SCHEMBL856822

COC(=O)[C@H]1C(C(=O)Nc2ccc(Br)cc2)[C@@H]2CC[C@H]1C21CC1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 19/20 0.78
FPR1 P21462 1/20 0.74
FPR3 P25089 8/20 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
SCHEMBL727350 1.00 FPR2 (0.78) FPR2FPR1FPR3
SCHEMBL2683245 1.00 FPR2 (0.78) FPR2FPR1FPR3
SCHEMBL9985206 0.89 FPR2 (0.75) FPR2FPR1FPR3
SCHEMBL728813 0.89 FPR2 (0.75) FPR2FPR1FPR3
SCHEMBL728574 0.88 FPR2 (0.73) FPR2FPR1FPR3
SCHEMBL854989 0.88 FPR2 (1.00) FPR2FPR1FPR3
SCHEMBL728485 0.88 FPR2 (1.00) FPR2FPR1FPR3
SCHEMBL2684413 0.88 FPR2 (1.00) FPR2FPR1FPR3
SCHEMBL724717 0.87 FPR2 (1.00) FPR2FPR1FPR3
SCHEMBL9985273 0.87 FPR2 (1.00) FPR2FPR1FPR3

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-2432760-A1 BRIDGED SPIRO [2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-28 EP disclosed