SCHEMBL5743475

SCHEMBL5743475

Cc1cc(-c2ccccc2C)ccc1C(=O)NS(=O)(=O)c1ccc(NCC23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])c1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 14/20 0.43
MCL1 Q07820 6/20 0.43
BCL2L1 Q07817 11/20 0.43
P2RX7 Q99572 1/20 0.43
SCN9A Q15858 1/20 0.40

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
SCHEMBL2947044 0.85 BCL2L1 (0.47) BCL2MCL1BCL2L1
SCHEMBL2944693 0.83 BCL2L1 (0.59) BCL2MCL1BCL2L1
SCHEMBL2947167 0.83 BCL2L1 (0.47) BCL2MCL1BCL2L1
SCHEMBL2951339 0.82 BCL2L1 (0.57) BCL2MCL1BCL2L1
SCHEMBL2953391 0.82 BCL2L1 (0.51) BCL2MCL1BCL2L1
SCHEMBL2946326 0.81 BCL2L1 (0.47) BCL2MCL1BCL2L1
SCHEMBL2950847 0.81 BCL2L1 (0.51) BCL2MCL1BCL2L1
SCHEMBL2948953 0.79 BCL2L1 (0.50) BCL2MCL1BCL2L1
SCHEMBL2952249 0.79 BCL2L1 (0.62) BCL2MCL1BCL2L1
SCHEMBL2945360 0.79 BCL2L1 (0.51) BCL2MCL1BCL2L1

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-1318978-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2006-02-08 EP disclosed