SCHEMBL17796028

SCHEMBL17796028

CS(=O)(=O)C1(S(C)(=O)=O)CCC(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(OCC5(F)CCOCC5)c([N+](=O)[O-])c4)c(Oc4cc5cc[nH]c5cc4F)c3)CC2)=C(c2ccc(Cl)cc2)C1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 17/20 0.79

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
SCHEMBL1955205 0.95 BCL2 (0.87) BCL2
SCHEMBL1956887 0.92 BCL2 (0.80) BCL2
SCHEMBL1956054 0.89 BCL2 (0.87) BCL2
SCHEMBL1958076 0.88 BCL2 (1.00) BCL2
SCHEMBL1957813 0.88 BCL2 (0.81) BCL2
SCHEMBL1958702 0.87 BCL2 (1.00) BCL2
SCHEMBL1957017 0.87 BCL2 (1.00) BCL2
SCHEMBL1956992 0.86 — —
SCHEMBL1958175 0.86 BCL2 (1.00) BCL2
SCHEMBL1958007 0.85 BCL2 (1.00) BCL2

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-3028702-A1 METHODS OF TREATMENT USING SELECTIVE BCL-2 INHIBITORS AbbVie Bahamas Limited (BS) 2016-06-08 — — EP disclosed
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