SCHEMBL30687646

SCHEMBL30687646

CCOc1cccc(-c2ccc(C(=O)N3CCN(c4ccc(C(=O)NS(=O)(=O)c5ccc(NCCSc6ccccc6)c(C(F)(F)F)c5)nn4)CC3)cc2C)c1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 11/20 0.42
▸ BCL2 P10415 8/20 0.42
▸ MGLL Q99685 1/20 0.39
▸ SCD O00767 5/20 0.37
▸ MCL1 Q07820 1/20 0.37
▸ DCTPP1 Q9H773 1/20 0.36

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
SCHEMBL26682365 1.00 BCL2L1 (0.42) BCL2L1BCL2MGLLSCDMCL1
SCHEMBL30687597 0.95 BCL2L1 (0.42) BCL2L1BCL2MGLLSCDMCL1
SCHEMBL26682558 0.95 BCL2L1 (0.42) BCL2L1BCL2MGLLSCDMCL1
SCHEMBL30687706 0.94 BCL2L1 (0.41) BCL2L1BCL2SCDMCL1DCTPP1
SCHEMBL26682928 0.94 BCL2L1 (0.41) BCL2L1BCL2SCDMCL1DCTPP1
SCHEMBL26681350 0.92 BCL2L1 (0.43) BCL2L1BCL2SCDMCL1DCTPP1
SCHEMBL26682648 0.91 SCD (0.42) BCL2L1BCL2SCDDCTPP1
SCHEMBL30687907 0.91 SCD (0.42) BCL2L1BCL2SCDDCTPP1
SCHEMBL30687912 0.90 BCL2L1 (0.42) BCL2L1BCL2
SCHEMBL26682049 0.90 BCL2L1 (0.42) BCL2L1BCL2

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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