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SCHEMBL23073055

SCHEMBL23073055

Cc1cc(-c2cc(C[S+](C)[O-])c3nc(C)n(CC4CC4)c3c2)cn(C)c1=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 19/20 0.46
▸ BAZ2A Q9UIF9 6/20 0.46
▸ TLR4 O00206 1/20 0.39
▸ TLR9 Q9NR96 1/20 0.39
▸ TLR8 Q9NR97 1/20 0.39
▸ TLR7 Q9NYK1 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
SCHEMBL23473037 0.87 BRD4 (0.48) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL20158761 0.86 BRD4 (0.54) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL23073056 0.85 BRD4 (0.48) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL23473105 0.84 BRD4 (0.46) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL18152859 0.84 BRD4 (0.47) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL23073148 0.83 BRD4 (0.46) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL23073025 0.81 BRD4 (0.49) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL18152807 0.80 BRD4 (0.48) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL18152904 0.80 BRD4 (0.48) BRD4BAZ2ATLR4TLR9TLR8
SCHEMBL23073071 0.79 BRD4 (0.48) BRD4BAZ2ATLR4TLR9TLR8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3831383-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2021-06-09 — — EP disclosed
EP-3283077-B1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2021-03-10 — — EP disclosed