SCHEMBL6818970

SCHEMBL6818970

CCNC(=O)c1cc2c(C(=O)Nc3ccc(C#N)cc3C(=O)O)noc2cc1-c1ccc(NC(C)=O)cc1C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 2/20 0.36
MAPK14 Q16539 2/20 0.35
EGLN2 Q96KS0 1/20 0.34
EGLN1 Q9GZT9 2/20 0.34
PPARG P37231 1/20 0.34
ALB P02768 2/20 0.33
BACE1 P56817 1/20 0.33
EIF2S1 P05198 1/20 0.33
EIF2AK3 Q9NZJ5 1/20 0.33
RORC P51449 1/20 0.33
POLB P06746 2/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
LRRK2 Q5S007 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PDE10A Q9Y233 1/20 0.32

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
SCHEMBL6818959 0.98 HSP90AB1 (0.35) HSP90AB1MAPK14EGLN2EGLN1PPARG
SCHEMBL6822517 0.91 EGLN2 (0.39) MAPK14EGLN2PPARGALBPOLB
SCHEMBL6818615 0.90 RORC (0.35) HSP90AB1PPARGALBBACE1RORC
SCHEMBL6822410 0.89 EGLN2 (0.38) MAPK14EGLN2PPARGALBPOLB
SCHEMBL6818290 0.89 EGLN2 (0.37) MAPK14EGLN2PPARGALBRORC
SCHEMBL6814235 0.88 EGLN2 (0.37) MAPK14EGLN2PPARGALBRORC
SCHEMBL6819036 0.88 RORC (0.35) HSP90AB1PPARGALBRORCPDE10A
SCHEMBL6818149 0.88 LRRK2 (0.36) EGLN2ALBPOLBTP53MAPT
SCHEMBL6822324 0.87 RXFP1 (0.40) EGLN2PPARGALBRORCPOLB
SCHEMBL6818824 0.85 HIF1A (0.37) MAPK14EGLN2ALBPOLBTP53

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-2004018428-A1 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO disclosed