SCHEMBL8319557

SCHEMBL8319557

CC(C)(C)OC(=O)N1CCc2sc(C(=O)NCC(c3ccc(C(C)(O)C(=O)O)cc3)n3ccnc3)cc2C1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 13/20 0.42
PRMT5 O14744 4/20 0.41
WDR77 Q9BQA1 4/20 0.41
HDAC6 Q9UBN7 1/20 0.39
CYP27B1 O15528 1/20 0.38

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
SCHEMBL8318232 0.88 PRMT5 (0.42) CYP24A1PRMT5WDR77HDAC6
SCHEMBL8319550 0.87 PRMT5 (0.42) CYP24A1PRMT5WDR77HDAC6
SCHEMBL8319561 0.86 CYP24A1 (0.41) CYP24A1PRMT5WDR77HDAC6
SCHEMBL8318234 0.74 PRMT5 (0.48) PRMT5WDR77HDAC6
SCHEMBL8314351 0.73 PRMT5 (0.49) PRMT5WDR77HDAC6
SCHEMBL8560838 0.72 PRMT5 (0.46) PRMT5WDR77HDAC6
SCHEMBL8457084 0.71 PRMT5 (0.45) PRMT5WDR77HDAC6
SCHEMBL1174513 0.71 HDAC6 (0.72) PRMT5WDR77HDAC6
SCHEMBL8318125 0.71 PRMT5 (0.44) PRMT5WDR77HDAC6
SCHEMBL8557682 0.70 PRMT5 (0.47) PRMT5WDR77HDAC6

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-0897920-A1 NOVEL HETEROCYCLIC COMPOUNDS HAVING PLATELET AGGREGATION INHIBITORY EFFECTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-02-24 EP disclosed