SCHEMBL855441

SCHEMBL855441

COC(=O)[C@H]1C(C(=O)NCCc2ccc(Cl)cc2Cl)[C@@H]2C=C[C@H]1C21CC1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FPR3 P25089 13/20 0.67
FPR2 P25090 8/20 0.67
P2RX7 Q99572 2/20 0.46
ALDH1A1 P00352 1/20 0.45
CNR1 P21554 1/20 0.44
METAP2 P50579 2/20 0.43

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
SCHEMBL2682344 1.00 FPR3 (0.67) FPR3FPR2P2RX7ALDH1A1CNR1
SCHEMBL856921 0.88 FPR3 (0.71) FPR3FPR2P2RX7ALDH1A1CNR1
SCHEMBL2683547 0.88 FPR3 (0.71) FPR3FPR2P2RX7ALDH1A1CNR1
SCHEMBL2683287 0.85 FPR3 (0.74) FPR3FPR2ALDH1A1
SCHEMBL2682717 0.81 FPR3 (1.00) FPR3FPR2
SCHEMBL2682166 0.72 FPR3 (0.76) FPR3FPR2ALDH1A1
SCHEMBL856708 0.72 FPR3 (0.76) FPR3FPR2ALDH1A1
SCHEMBL2684819 0.71 FPR3 (1.00) FPR3FPR2
SCHEMBL2682087 0.71 FPR2 (0.72) FPR3FPR2
SCHEMBL855312 0.69 FPR2 (0.65) FPR3FPR2

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