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Sugi Predict / Compounds / SCHEMBL431065

SCHEMBL431065

SCHEMBL431065

N=C(NS(=O)(=O)c1ccc(NCCC(CSc2ccccc2)N2CCOCC2)c([N+](=O)[O-])c1)c1ccc(N2CCN(CC=C(c3ccccc3)c3ccccc3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 20/20 0.58
▸ BCL2 P10415 12/20 0.50

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
SCHEMBL376619 0.89 BCL2L1 (0.64) BCL2L1BCL2
SCHEMBL3590505 0.86 BCL2L1 (0.67) BCL2L1BCL2
SCHEMBL376605 0.82 BCL2L1 (0.71) BCL2L1BCL2
SCHEMBL3601748 0.81 BCL2L1 (0.64) BCL2L1BCL2
SCHEMBL376434 0.78 BCL2L1 (0.46) BCL2L1BCL2
SCHEMBL376604 0.78 BCL2L1 (0.46) BCL2L1BCL2
SCHEMBL13503607 0.77 BCL2L1 (0.58) BCL2L1BCL2
SCHEMBL3589313 0.77 BCL2L1 (0.58) BCL2L1BCL2
SCHEMBL376618 0.77 BCL2L1 (0.58) BCL2L1BCL2
SCHEMBL376908 0.75 BCL2L1 (0.84) BCL2L1BCL2

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-1765778-B1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2012-01-25 — — EP disclosed