SCHEMBL5789183

SCHEMBL5789183

CCNC(=O)ON1CCc2c(c(-c3ccc(Cl)c(C)c3)nn2CC(O)CN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 20/20 0.76

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
SCHEMBL5787032 0.94 CTSS (0.77) CTSS
SCHEMBL5527971 0.90 CTSS (0.85) CTSS
SCHEMBL5534346 0.86 CTSS (0.88) CTSS
SCHEMBL5530493 0.86 CTSS (1.00) CTSS
SCHEMBL5530498 0.86 CTSS (1.00) CTSS
SCHEMBL7105904 0.86 CTSS (0.90) CTSS
SCHEMBL5531853 0.84 CTSS (1.00) CTSS
SCHEMBL5531040 0.82 CTSS (0.91) CTSS
SCHEMBL5533946 0.81 CTSS (0.90) CTSS
SCHEMBL5788646 0.80 CTSS (0.72) CTSS

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-1309593-B1 SUBSTITUTED PYRAZOLES ORTHO MCNEIL PHARM INC (US) 2006-03-15 — — EP claimed
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