SCHEMBL22562926

SCHEMBL22562926

COCCOCCn1nc2cc([S+]([O-])NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CC6(CCC6)CC5)CC4)cc3Oc3cnc4[nH]ccc4c3)cc([N+](=O)[O-])c2c1F

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 20/20 0.64

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
SCHEMBL22562890 0.92 BCL2 (0.69) BCL2
SCHEMBL29375881 0.91 BCL2 (0.75) BCL2
SCHEMBL20580461 0.91 BCL2 (0.75) BCL2
SCHEMBL21573218 0.89 BCL2 (0.71) BCL2
SCHEMBL24519920 0.89 BCL2 (0.60) BCL2
SCHEMBL23653665 0.88 BCL2 (0.59) BCL2
SCHEMBL19853626 0.87 BCL2 (0.69) BCL2
SCHEMBL19853635 0.87 BCL2 (0.72) BCL2
SCHEMBL21573183 0.87 BCL2 (0.69) BCL2
SCHEMBL19853740 0.86 BCL2 (0.69) 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-3494115-B1 N-(PHENYLSULFONYL)BENZAMIDE DERIVATIVES AS BCL-2 INHIBITORS UNIV MICHIGAN REGENTS (US) 2020-10-21 — — EP disclosed
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