SCHEMBL10316824

SCHEMBL10316824

CN1CCN(CC[C@H](CSc2ccccc2F)Nc2ccc(S(=O)(=O)Nc3ncnc4c3CCN(C3CCN(Cc5cc(Cl)ccc5-c5ccccc5)CC3)C4)cc2S(=O)(=O)C(F)(F)F)CC1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 18/20 0.71
▸ BCL2L1 Q07817 18/20 0.71
▸ BCL2L2 Q92843 1/20 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
SCHEMBL1497723 0.95 BCL2L1 (0.75) BCL2BCL2L1BCL2L2
SCHEMBL1497716 0.95 BCL2L1 (0.75) BCL2BCL2L1BCL2L2
SCHEMBL9951289 0.91 BCL2 (0.70) BCL2BCL2L1BCL2L2
SCHEMBL1497473 0.91 BCL2 (0.70) BCL2BCL2L1BCL2L2
SCHEMBL9951294 0.88 BCL2 (0.88) BCL2BCL2L1BCL2L2
SCHEMBL9951333 0.88 BCL2 (0.61) BCL2BCL2L1BCL2L2
SCHEMBL9951325 0.88 BCL2 (0.61) BCL2BCL2L1BCL2L2
SCHEMBL9951785 0.86 BCL2L1 (0.85) BCL2BCL2L1BCL2L2
SCHEMBL15327638 0.85 BCL2L1 (0.85) BCL2BCL2L1BCL2L2
SCHEMBL10166395 0.85 BCL2L1 (0.85) 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 1 patent. 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
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