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SCHEMBL5743859

SCHEMBL5743859

COc1cc(C(=O)NS(=O)(=O)c2ccc(N[C@H](CCCCNC(=O)O)CSc3ccccc3)c([N+](=O)[O-])c2)ccc1-c1ccc(CCN(C)CCN(C)C)cc1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 20/20 0.68
▸ BCL2 P10415 17/20 0.68
▸ ALB P02768 1/20 0.66

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
SCHEMBL5743852 1.00 BCL2L1 (0.68) BCL2L1BCL2ALB
SCHEMBL4469309 0.97 BCL2L1 (0.73) BCL2L1BCL2ALB
SCHEMBL4469316 0.97 BCL2L1 (0.73) BCL2L1BCL2ALB
SCHEMBL2948357 0.92 BCL2L1 (0.68) BCL2L1BCL2ALB
SCHEMBL2948360 0.92 BCL2L1 (0.68) BCL2L1BCL2ALB
SCHEMBL2947592 0.90 BCL2L1 (0.78) BCL2L1BCL2ALB
SCHEMBL2952203 0.86 BCL2L1 (0.83) BCL2L1BCL2ALB
SCHEMBL4474744 0.84 BCL2L1 (0.78) BCL2L1BCL2ALB
SCHEMBL2943299 0.84 BCL2L1 (0.77) BCL2L1BCL2ALB
SCHEMBL2952588 0.83 BCL2L1 (0.74) BCL2L1BCL2ALB

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