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Sugi Predict / Compounds / SCHEMBL14415232

SCHEMBL14415232

SCHEMBL14415232

Cc1[nH]c2ccc(CI)cc2c1C1CCN(CC(O)Cn2nc(-c3ccc(Br)cc3)c3c2CCN(S(C)(=O)=O)C3)CC1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 20/20 0.70
▸ CD74 P04233 7/20 0.57

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
SCHEMBL4765124 0.91 CTSS (0.84) CTSSCD74
SCHEMBL4767653 0.82 CTSS (1.00) CTSSCD74
SCHEMBL4764801 0.79 CTSS (1.00) CTSSCD74
SCHEMBL5254774 0.77 CTSS (0.85) CTSSCD74
SCHEMBL5251651 0.77 CTSS (1.00) CTSSCD74
SCHEMBL4713255 0.76 CTSS (1.00) CTSSCD74
SCHEMBL5541197 0.75 CTSS (0.74) CTSSCD74
SCHEMBL5255034 0.75 CTSS (1.00) CTSSCD74
SCHEMBL5534051 0.75 CTSS (0.69) CTSSCD74
SCHEMBL5254294 0.75 CTSS (0.84) 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
US-7265102-B2 Substituted pyrazoles ORTHO MCNEIL PHARMACEUTICAL, INC. (US) 2007-09-04 — — US disclosed