SCHEMBL26680915

SCHEMBL26680915

CCOc1cncc(-c2cc(CN3CCN(c4ccc(C(=O)NS(=O)(=O)c5ccc(NCCSc6ccccc6)c([N+](=O)[O-])c5)cc4)CC3)cc(OC(F)(F)F)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 20/20 0.59
▸ BCL2 P10415 12/20 0.59
▸ MCL1 Q07820 4/20 0.50
▸ BAK1 Q16611 1/20 0.49
▸ BCL2L2 Q92843 1/20 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
SCHEMBL26680350 0.95 BCL2L1 (0.63) BCL2L1BCL2MCL1BAK1
SCHEMBL26680937 0.94 BCL2L1 (0.61) BCL2L1BCL2MCL1BCL2L2
SCHEMBL26681944 0.94 BCL2L1 (0.59) BCL2L1BCL2MCL1BAK1BCL2L2
SCHEMBL26683299 0.93 BCL2L1 (0.59) BCL2L1BCL2MCL1BAK1
SCHEMBL26681585 0.92 BCL2L1 (0.61) BCL2L1BCL2MCL1BAK1
SCHEMBL26682076 0.92 BCL2L1 (0.47) BCL2L1BCL2BCL2L2
SCHEMBL26680856 0.91 BCL2L1 (0.61) BCL2L1BCL2MCL1BAK1
SCHEMBL26680739 0.90 BCL2L1 (0.46) BCL2L1BCL2MCL1BAK1
SCHEMBL26683127 0.89 BCL2L1 (0.66) BCL2L1BCL2MCL1BAK1
SCHEMBL26682178 0.89 BCL2L1 (0.49) BCL2L1BCL2BCL2L2

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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