SCHEMBL1497096

SCHEMBL1497096

COc1ccc(-c2ccc(Cl)cc2)c(CN2CCC(N3CCc4c(ncnc4NS(=O)(=O)c4ccc(N[C@H](C)CCSc5ccc(N(C)C)cc5)c(S(=O)(=O)C(F)(F)F)c4)C3)CC2)c1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 17/20 0.67
▸ BCL2L1 Q07817 16/20 0.67
▸ BCL2L2 Q92843 3/20 0.47

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
SCHEMBL1497213 0.93 BCL2 (0.76) BCL2BCL2L1BCL2L2
SCHEMBL1497115 0.89 BCL2 (0.65) BCL2BCL2L1BCL2L2
SCHEMBL1497065 0.89 BCL2 (0.69) BCL2BCL2L1BCL2L2
SCHEMBL1497183 0.88 BCL2 (0.68) BCL2BCL2L1BCL2L2
SCHEMBL1497099 0.87 BCL2 (0.69) BCL2BCL2L1BCL2L2
SCHEMBL1497169 0.86 BCL2 (0.76) BCL2BCL2L1BCL2L2
SCHEMBL9951273 0.86 BCL2 (0.89) BCL2BCL2L1BCL2L2
SCHEMBL1497194 0.86 BCL2 (0.66) BCL2BCL2L1BCL2L2
SCHEMBL9951266 0.86 BCL2 (0.89) BCL2BCL2L1BCL2L2
SCHEMBL1497185 0.85 BCL2 (0.76) BCL2BCL2L1BCL2L2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2475661-A1 SULFONAMIDES AS INHIBITORS OF BCL-2 FAMILY PROTEINS FOR THE TREATMENT OF CANCER Novartis AG (CH) 2012-07-18 — — EP disclosed
WO-2011029842-A1 SULFONAMIDES AS INHIBITORS OF BCL-2 FAMILY PROTEINS FOR THE TREATMENT OF CANCER NOVARTIS AG (CH) 2011-03-17 — — WO disclosed
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