SCHEMBL20384409

SCHEMBL20384409

CCS(=N)(=O)c1ccc(Oc2ccccc2F)c(-c2cn(C)c(=O)c3[nH]ccc23)c1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.80

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
SCHEMBL20384377 0.93 BRD4 (0.83) BRD4
SCHEMBL20384599 0.90 BRD4 (0.70) BRD4
SCHEMBL15067910 0.89 BRD4 (1.00) BRD4
SCHEMBL29745792 0.89 BRD4 (1.00) BRD4
SCHEMBL20384566 0.89 BRD4 (0.69) BRD4
SCHEMBL20384397 0.88 BRD4 (0.80) BRD4
SCHEMBL20384584 0.87 BRD4 (0.79) BRD4
SCHEMBL20384554 0.87 BRD4 (0.76) BRD4
SCHEMBL20384427 0.84 BRD4 (0.69) BRD4
SCHEMBL20384359 0.84 BRD4 (0.62) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018130174-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF IN MEDICINE 江苏豪森药业集团有限公司 2018-07-19 WO disclosed