SCHEMBL28033645

SCHEMBL28033645

Cc1nc(C(=O)Nc2cnn(Cc3nc(C(C)(C)O)co3)n2)c(-c2cccc(OC(F)(F)F)c2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 19/20 1.00
CACNA1H O95180 1/20 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
SCHEMBL28033644 0.89 FPR2 (1.00) FPR2
SCHEMBL9905603 0.88 FPR2 (0.80) FPR2CACNA1H
SCHEMBL28033117 0.87 FPR2 (1.00) FPR2
SCHEMBL1704153 0.85 FPR2 (1.00) FPR2
SCHEMBL1704432 0.84 FPR2 (0.72) FPR2CACNA1H
SCHEMBL1704147 0.83 FPR2 (0.86) FPR2
SCHEMBL1704455 0.83 FPR2 (0.71) FPR2CACNA1H
SCHEMBL9900708 0.82 FPR2 (0.84) FPR2
SCHEMBL2130268 0.81 FPR2 (0.87) FPR2
SCHEMBL2324608 0.81 FPR2 (0.69) FPR2CACNA1H

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
CN-103249413-B As the hydroxylating aminotriazole derivatives of lipoxin (ALX) receptor stimulating agent ACTELION PHARMACEUTICALS LTD. (CH) 2015-11-25 CN claimed
CN-103249413-B As the hydroxylating aminotriazole derivatives of lipoxin (ALX) receptor stimulating agent ACTELION PHARMACEUTICALS LTD. (CH) 2015-11-25 CN disclosed