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SCHEMBL26680446

SCHEMBL26680446

CCOc1cccc(-c2cc(C(=O)N3CCN(c4ccc(C(=O)NS(=O)(=O)c5ccc(NCCSc6ccccc6)c(C(F)(F)F)c5)nn4)CC3)cc(C(C)(C)C)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 8/20 0.42
▸ BCL2 P10415 5/20 0.42
▸ SCD O00767 10/20 0.37
▸ DCTPP1 Q9H773 2/20 0.36
▸ MCL1 Q07820 1/20 0.35

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
SCHEMBL30687621 1.00 BCL2L1 (0.42) BCL2L1BCL2SCDDCTPP1MCL1
SCHEMBL30687712 0.97 BCL2L1 (0.41) BCL2L1BCL2SCDDCTPP1MCL1
SCHEMBL26657600 0.97 BCL2L1 (0.41) BCL2L1BCL2SCDDCTPP1MCL1
SCHEMBL26681309 0.95 BCL2L1 (0.41) BCL2L1BCL2SCDDCTPP1
SCHEMBL30687771 0.95 BCL2L1 (0.41) BCL2L1BCL2SCDDCTPP1
SCHEMBL26682812 0.92 BCL2L1 (0.42) BCL2L1BCL2SCDDCTPP1
SCHEMBL26682895 0.91 BCL2L1 (0.41) BCL2L1BCL2SCDDCTPP1MCL1
SCHEMBL26683316 0.91 BCL2L1 (0.53) BCL2L1BCL2MCL1
SCHEMBL26681685 0.89 BCL2L1 (0.53) BCL2L1BCL2MCL1
SCHEMBL26680706 0.89 BCL2L1 (0.51) 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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