SCHEMBL30687866

SCHEMBL30687866

O=C(NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(C(F)(F)F)c1)c1ccc(N2CCN(Cc3ccc(-c4cncc(O)c4)c4ccccc34)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 20/20 0.51
▸ BCL2 P10415 11/20 0.51
▸ BCL2L2 Q92843 1/20 0.49
▸ MCL1 Q07820 1/20 0.44

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
SCHEMBL26682887 1.00 BCL2L1 (0.51) BCL2L1BCL2BCL2L2MCL1
SCHEMBL26680448 0.93 BCL2L1 (0.52) BCL2L1BCL2BCL2L2
SCHEMBL26682172 0.92 BCL2L1 (0.52) BCL2L1BCL2BCL2L2
SCHEMBL26681148 0.91 BCL2L1 (0.49) BCL2L1BCL2BCL2L2
SCHEMBL26681966 0.90 BCL2L1 (0.48) BCL2L1BCL2BCL2L2MCL1
SCHEMBL26682136 0.90 BCL2L1 (0.50) BCL2L1BCL2BCL2L2
SCHEMBL30687726 0.90 BCL2L1 (0.48) BCL2L1BCL2BCL2L2MCL1
SCHEMBL26680413 0.90 BCL2L1 (0.65) BCL2L1BCL2MCL1
SCHEMBL26681210 0.89 BCL2L1 (0.49) BCL2L1BCL2BCL2L2
SCHEMBL26681922 0.89 BCL2L1 (0.54) 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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