SCHEMBL5310375

SCHEMBL5310375

NC(=O)C1=Cn2c(cc3ccc(C(N)=O)cc32)C2=CCC=CC2=C1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 1/20 0.37
KDM4E B2RXH2 1/20 0.30
BRD4 O60885 1/20 0.30
ALDH1A1 P00352 1/20 0.30
BRPF1 P55201 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
LCK P06239 1/20 0.30

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
SCHEMBL5332877 0.86
SCHEMBL1118323 0.81 RPS6KA3 (0.38) RPS6KA3KDM4EBRD4ALDH1A1BRPF1
SCHEMBL50474 0.68 RPS6KA3 (0.39) RPS6KA3KDM4EBRD4ALDH1A1BRPF1
SCHEMBL3945086 0.62 RPS6KA3 (0.40) RPS6KA3KDM4EBRD4ALDH1A1BRPF1
SCHEMBL841837 0.61 RPS6KA3 (0.41) RPS6KA3KDM4EBRD4ALDH1A1BRPF1
SCHEMBL5329442 0.60 SRD5A2 (0.39) RPS6KA3
SCHEMBL1978812 0.58 RPS6KA3 (0.85) RPS6KA3
SCHEMBL4823385 0.58 RPS6KA3 (0.41) RPS6KA3
SCHEMBL4831486 0.58 RPS6KA3 (0.41) RPS6KA3
SCHEMBL4829827 0.58 RPS6KA3 (0.41) RPS6KA3

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-2007033175-A1 INDOLOBENZAZEPINE HCV NS5B INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-22 WO disclosed