SCHEMBL31444637

SCHEMBL31444637

CN1C(=O)Cc2cc(Nc3nc(N4CCC(Nc5ccc6c(c5)n(C)c(=O)n6C5CCC(=O)NC5=O)CC4)ncc3Cl)ccc21

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 19/20 0.43
▸ NCOR2 Q9Y618 5/20 0.40
▸ DDB1 Q16531 1/20 0.40
▸ CRBN Q96SW2 1/20 0.40
▸ ADRB3 P13945 1/20 0.39
▸ HTR1D P28221 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ TMEM97 Q5BJF2 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL31444710 0.87 BCL6 (0.39) BCL6NCOR2CRBN
SCHEMBL31520838 0.83 BCL6 (0.66) BCL6NCOR2ADRB3HTR1DADORA1
SCHEMBL30661506 0.83 DDB1 (0.54) BCL6NCOR2DDB1CRBN
SCHEMBL30661491 0.83 DDB1 (0.54) BCL6NCOR2DDB1CRBN
SCHEMBL31701289 0.81 DDB1 (0.51) BCL6NCOR2DDB1CRBN
SCHEMBL31444600 0.81 BCL6 (0.37) BCL6NCOR2DDB1CRBN
SCHEMBL30661632 0.80 DDB1 (0.44) BCL6NCOR2DDB1CRBN
SCHEMBL31444594 0.79 BCL6 (0.39) BCL6NCOR2
SCHEMBL31444734 0.78 DDB1 (0.54) BCL6NCOR2DDB1CRBN
SCHEMBL31520578 0.76 DDB1 (0.57) BCL6NCOR2DDB1CRBNADRB3

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
WO-2025096710-A1 MODULATORS OF BCL6 AS LIGAND DIRECTED DEGRADERS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-08 — — WO disclosed
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