SCHEMBL26681106

SCHEMBL26681106

O=C(NS(=O)(=O)c1ccc(NCCSc2ccccc2)c([N+](=O)[O-])c1)c1ccc(N2CCN(C(=O)c3ccc(-c4cncc(O)c4)c4ccccc34)CC2)nn1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 20/20 0.53
▸ BCL2 P10415 17/20 0.51
▸ MCL1 Q07820 10/20 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
SCHEMBL30687884 1.00 BCL2L1 (0.53) BCL2L1BCL2MCL1
SCHEMBL26680282 0.93 BCL2L1 (0.54) BCL2L1BCL2MCL1
SCHEMBL26680255 0.91 BCL2L1 (0.51) BCL2L1BCL2MCL1
SCHEMBL26681525 0.90 BCL2L1 (0.56) BCL2L1BCL2MCL1
SCHEMBL30687820 0.90 BCL2L1 (0.54) BCL2L1BCL2MCL1
SCHEMBL26680372 0.90 BCL2L1 (0.54) BCL2L1BCL2MCL1
SCHEMBL26681544 0.90 SCD (0.42) BCL2L1BCL2
SCHEMBL26681941 0.90 BCL2L1 (0.49) BCL2L1BCL2MCL1
SCHEMBL30687854 0.89 BCL2L1 (0.68) BCL2L1BCL2MCL1
SCHEMBL26681397 0.89 BCL2L1 (0.68) BCL2L1BCL2MCL1

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-4279476-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-22 — — EP disclosed
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