SCHEMBL2330879

SCHEMBL2330879

CC(=O)c1ccc(Cn2ncc(NC(=O)c3ncoc3-c3cccc(F)c3)n2)o1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 11/20 0.60
HCRTR1 O43613 2/20 0.60
FPR2 P25090 8/20 0.55
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL2328926 0.91 HCRTR2 (0.72) HCRTR2HCRTR1FPR2
SCHEMBL2328979 0.90 FPR2 (0.64) HCRTR2HCRTR1FPR2
SCHEMBL2324771 0.90 FPR2 (0.62) HCRTR2HCRTR1FPR2KDM4E
SCHEMBL2323231 0.90 FPR2 (0.68) HCRTR2HCRTR1FPR2KDM4E
SCHEMBL2327727 0.90 HCRTR2 (0.58) HCRTR2HCRTR1FPR2MAPT
SCHEMBL2327561 0.89 HCRTR2 (0.58) HCRTR2HCRTR1FPR2
SCHEMBL2327045 0.89 FPR2 (0.65) HCRTR2HCRTR1FPR2
SCHEMBL2327503 0.88 FPR2 (0.57) HCRTR2HCRTR1FPR2
SCHEMBL2328204 0.88 HCRTR2 (0.58) HCRTR2HCRTR1FPR2
SCHEMBL2327838 0.88 HCRTR2 (0.58) HCRTR2HCRTR1FPR2

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