SCHEMBL1497034

SCHEMBL1497034

C[C@H](CCN(C)C)N(Sc1c(Cl)cccc1Cl)c1ccc(S(=O)(=O)Nc2ncnc3c2CCN(C2CCN(Cc4ccccc4-c4ccc(Cl)cc4)CC2)C3)cc1S(=O)(=O)C(F)(F)F

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 18/20 0.71
▸ BCL2L1 Q07817 13/20 0.71
▸ BCL2L2 Q92843 3/20 0.49

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
SCHEMBL9951784 0.87 BCL2 (0.89) BCL2BCL2L1BCL2L2
SCHEMBL9951787 0.87 BCL2 (0.89) BCL2BCL2L1BCL2L2
SCHEMBL9951712 0.87 BCL2 (0.68) BCL2BCL2L1BCL2L2
SCHEMBL9951244 0.84 BCL2 (0.89) BCL2BCL2L1BCL2L2
SCHEMBL9951245 0.84 BCL2 (0.89) BCL2BCL2L1BCL2L2
SCHEMBL9951694 0.83 BCL2 (0.94) BCL2BCL2L1BCL2L2
SCHEMBL9951027 0.83 BCL2 (1.00) BCL2BCL2L1BCL2L2
SCHEMBL9951020 0.83 BCL2 (1.00) BCL2BCL2L1BCL2L2
SCHEMBL15327445 0.83 BCL2 (0.93) BCL2BCL2L1BCL2L2
SCHEMBL10166411 0.83 BCL2 (0.93) 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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