SCHEMBL2328508

SCHEMBL2328508

CC(F)(F)CCCCn1ncc(NC(=O)c2ncoc2-c2ccccc2)n1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 8/20 0.61
HCRTR2 O43614 11/20 0.47
HCRTR1 O43613 3/20 0.46
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL2331282 0.86 FPR2 (0.63) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL1166020 0.85 FPR2 (0.58) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL1166196 0.83 HCRTR2 (0.62) HCRTR2HCRTR1
SCHEMBL1704324 0.80 FPR2 (0.64) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL1703979 0.77 FPR2 (0.67) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL28822498 0.76 FPR2 (1.00) FPR2HCRTR2
SCHEMBL15284127 0.75 FPR2 (0.62) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL2324144 0.75 FPR2 (0.69) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL2323231 0.74 FPR2 (0.68) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL2324572 0.74 FPR2 (0.68) FPR2HCRTR2HCRTR1KDM4E

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
EP-2225231-B1 AMINOTRIAZOLE DERIVATIVES AS ALX AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-08-17 EP claimed
EP-2225231-B1 AMINOTRIAZOLE DERIVATIVES AS ALX AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-08-17 EP disclosed