SCHEMBL14655243

SCHEMBL14655243

O=C(NS(=O)(=O)c1ccc(NCC2CCCCC2)c([N+](=O)[O-])c1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.59
ALDH1A1 P00352 1/20 0.59
HTT P42858 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
BCL2L1 Q07817 17/20 0.58
BCL2 P10415 13/20 0.58
MCL1 Q07820 11/20 0.58
MAPK1 P28482 1/20 0.54
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
GPR55 Q9Y2T6 1/20 0.48
BAK1 Q16611 1/20 0.48

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
SCHEMBL1955748 0.91 BCL2L1 (0.59) MAPTBCL2L1BCL2MCL1MAPK1
SCHEMBL30112869 0.91 BCL2L1 (0.58) MAPTALDH1A1HTTSMN1; SMN2BCL2L1
SCHEMBL30112781 0.90 BCL2L1 (0.57) MAPTALDH1A1HTTSMN1; SMN2BCL2L1
SCHEMBL29588272 0.90 BCL2L1 (0.57) MAPTALDH1A1HTTSMN1; SMN2BCL2L1
SCHEMBL30112824 0.89 BCL2L1 (0.56) MAPTALDH1A1HTTSMN1; SMN2BCL2L1
SCHEMBL30622006 0.89 BCL2L1 (0.54) MAPTALDH1A1HTTSMN1; SMN2BCL2L1
SCHEMBL29644474 0.89 BCL2L1 (0.54) MAPTALDH1A1HTTSMN1; SMN2BCL2L1
SCHEMBL30112778 0.89 BCL2L1 (0.55) MAPTALDH1A1HTTSMN1; SMN2BCL2L1
SCHEMBL29588211 0.89 BCL2L1 (0.55) MAPTBCL2L1BCL2MCL1MAPK1
SCHEMBL2951985 0.88 BCL2L1 (0.62) MAPTALDH1A1HTTSMN1; SMN2BCL2L1

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-2550258-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbvie Inc. (US) 2013-01-30 EP disclosed