SCHEMBL30302435

SCHEMBL30302435

Cc1cccc(C)c1Cn1c(C)nc2c(CCS(N)(=O)=O)cc(-c3cn(C)c(=O)c4[nH]ccc34)nc21

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 20/20 0.53

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
SCHEMBL30302429 0.86 BRD4 (0.53) BRD4
SCHEMBL30302467 0.86 BRD4 (0.72) BRD4
SCHEMBL30302446 0.85 BRD4 (0.64) BRD4
SCHEMBL22492881 0.82 BRD4 (0.74) BRD4
SCHEMBL22516605 0.79 BRD4 (0.57) BRD4
SCHEMBL30302444 0.76 BRD4 (0.63) BRD4
SCHEMBL30302431 0.75 BRD4 (0.65) BRD4
SCHEMBL30302451 0.74 BRD4 (0.55) BRD4
SCHEMBL30302397 0.73 BRD4 (0.60) BRD4
SCHEMBL30302466 0.73 BRD4 (0.56) BRD4

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
CN-111712496-B Compounds and compositions as bromodomain protein inhibitors 贝达药业股份有限公司 2023-05-02 — — CN claimed
CN-111712496-B Compounds and compositions as bromodomain protein inhibitors 贝达药业股份有限公司 2023-05-02 — — CN disclosed
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