SCHEMBL5790852

SCHEMBL5790852

Cc1cccc2c1N(C1CCN(CCCn3nc(-c4ccc(C(F)(F)F)cc4)c4c3CCN(OC(N)=O)C4)CC1)C(=O)CO2

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 20/20 0.76
▸ CD74 P04233 12/20 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
SCHEMBL5790260 0.92 CTSS (0.73) CTSSCD74
SCHEMBL5532253 0.91 CTSS (0.78) CTSSCD74
SCHEMBL5538469 0.89 CTSS (0.82) CTSSCD74
SCHEMBL5533929 0.87 CTSS (0.83) CTSSCD74
SCHEMBL5535451 0.86 CTSS (1.00) CTSSCD74
SCHEMBL5788292 0.85 CTSS (0.71) CTSSCD74
SCHEMBL5532224 0.84 CTSS (0.80) CTSSCD74
SCHEMBL5532532 0.82 CTSS (0.77) CTSSCD74
SCHEMBL5528483 0.80 CTSS (0.78) CTSSCD74
SCHEMBL5534928 0.80 CTSS (0.73) CTSSCD74

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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