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SCHEMBL30687676

SCHEMBL30687676

CCOc1cncc(-c2cnn(-c3cc(C(=O)N4CCN(c5ccc(C(=O)NS(=O)(=O)c6ccc(NCCSc7ccccc7)c(C(F)(F)F)c6)cc5)CC4)cc(C(F)(F)F)c3)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 20/20 0.48
▸ BCL2 P10415 14/20 0.48
▸ MCL1 Q07820 5/20 0.38
▸ BCL2L2 Q92843 1/20 0.37

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
SCHEMBL26682016 1.00 BCL2L1 (0.48) BCL2L1BCL2MCL1BCL2L2
SCHEMBL26681500 0.95 BCL2L1 (0.48) BCL2L1BCL2MCL1BCL2L2
SCHEMBL26680869 0.93 BCL2L1 (0.59) BCL2L1BCL2MCL1
SCHEMBL26680598 0.93 BCL2L1 (0.52) BCL2L1BCL2MCL1BCL2L2
SCHEMBL26682446 0.91 BCL2L1 (0.49) BCL2L1BCL2MCL1BCL2L2
SCHEMBL30687844 0.91 BCL2L1 (0.49) BCL2L1BCL2MCL1BCL2L2
SCHEMBL26680755 0.91 BCL2L1 (0.39) BCL2L1BCL2MCL1
SCHEMBL30687894 0.91 BCL2L1 (0.39) BCL2L1BCL2MCL1
SCHEMBL26681824 0.89 BCL2L1 (0.52) BCL2L1BCL2MCL1BCL2L2
SCHEMBL26681728 0.88 BCL2L1 (0.59) 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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