SCHEMBL23073028

SCHEMBL23073028

CSNc1ncc(Oc2ccc(F)cc2F)c(-c2cc(C)c3nnc(C)n3c2)n1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 10/20 0.47
MAPK14 Q16539 7/20 0.38
MAPK8 P45983 5/20 0.37
BRD2 P25440 2/20 0.35
BRD3 Q15059 2/20 0.35
RPS6KA4 O75676 1/20 0.34
MAPK9 P45984 1/20 0.34
CSNK1E P49674 1/20 0.34
RPS6KA3 P51812 1/20 0.34
MAPK10 P53779 1/20 0.34
MAPK11 Q15759 1/20 0.34
NLK Q9UBE8 1/20 0.34
CREBBP Q92793 1/20 0.34

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
SCHEMBL23073080 0.91 BRD4 (0.47) BRD4MAPK14MAPK8BRD2BRD3
SCHEMBL18164465 0.86 BRD4 (0.62) BRD4MAPK14MAPK8MAPK9MAPK10
SCHEMBL19927971 0.84 BRD4 (0.64) BRD4MAPK14CREBBP
SCHEMBL19930720 0.82 BRD4 (0.68) BRD4MAPK14MAPK8CREBBP
SCHEMBL19931267 0.76 BRD4 (0.74) BRD4MAPK14MAPK8RPS6KA4MAPK9
SCHEMBL21916731 0.76 BRD4 (0.56) BRD4MAPK14MAPK8RPS6KA4MAPK9
SCHEMBL19931348 0.75 BRD4 (0.79) BRD4MAPK14MAPK8RPS6KA4MAPK9
SCHEMBL20159911 0.72 BRD4 (0.43) BRD4MAPK14BRD2BRD3CREBBP
SCHEMBL20160232 0.72 BRD4 (0.39) BRD4BRD2BRD3
SCHEMBL23073191 0.72

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
EP-3283077-B1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2021-03-10 EP disclosed