SCHEMBL2331377

SCHEMBL2331377

CC(=O)c1cc(Cn2ncc(NC(=O)c3ncoc3-c3ccccc3)n2)on1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 8/20 0.72
HCRTR2 O43614 9/20 0.45
HCRTR1 O43613 4/20 0.45
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40

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
SCHEMBL2330904 0.85 FPR2 (0.71) FPR2HCRTR2HCRTR1KDM4EMEN1
SCHEMBL2323231 0.84 FPR2 (0.68) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL2331066 0.84 FPR2 (0.68) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL2327710 0.84 FPR2 (1.00) FPR2HCRTR2
SCHEMBL2327726 0.84 FPR2 (0.75) FPR2HCRTR2HCRTR1KDM4EMEN1
SCHEMBL1166946 0.83 HCRTR2 (0.64) FPR2HCRTR2HCRTR1
SCHEMBL2328152 0.82 FPR2 (0.75) FPR2HCRTR2HCRTR1KDM4EMEN1
SCHEMBL2325544 0.82 FPR2 (0.67) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL2324144 0.81 FPR2 (0.69) FPR2HCRTR2HCRTR1KDM4E
SCHEMBL2327138 0.81 FPR2 (0.66) 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