SCHEMBL28625516

SCHEMBL28625516

CCN(c1ccc(Oc2ccc(F)cc2F)c(-c2cn(C)c(=O)c3[nH]ccc23)c1)S(N)(=O)=O

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.76
BRD2 P25440 1/20 0.67
ADORA2B P29275 1/20 0.67
TSPO P30536 1/20 0.67
EP300 Q09472 1/20 0.67
BRD3 Q15059 1/20 0.67
BRDT Q58F21 1/20 0.67

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
SCHEMBL25194685 0.89 BRD4 (0.75) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL29745828 0.86 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL15069550 0.86 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL15069508 0.85 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL29745671 0.85 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL15069378 0.85 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL29745818 0.85 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL15069595 0.85 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL29745744 0.84 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300
SCHEMBL15067752 0.84 BRD4 (1.00) BRD4BRD2ADORA2BTSPOEP300

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
CN-109384785-B Pyrrolopyridinone derivatives, preparation method and medical application thereof 浙江海正药业股份有限公司 2021-09-28 CN disclosed