SCHEMBL8410428

SCHEMBL8410428

N#Cc1ccc(NC=O)cc1C#N

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
EGLN2 Q96KS0 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.37
MAOB P27338 7/20 0.37
MAOA P21397 6/20 0.37
LMNA P02545 1/20 0.35
SLC22A12 Q96S37 5/20 0.35

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
SCHEMBL14730465 0.82 GRM4 (0.48) ALDH1A1EGLN2ABCG2SLC22A12
SCHEMBL25024871 0.82 ABCG2 (0.43) ALDH1A1EGLN2ABCG2LMNASLC22A12
SCHEMBL19144095 0.82 EGLN2 (0.50) ALDH1A1EGLN2
SCHEMBL8410032 0.82 SLC22A12 (0.51) ALDH1A1SLC22A12
SCHEMBL546977 0.80 SLC22A12 (0.56) SLC22A12
SCHEMBL17227549 0.79 ALDH1A1 (0.40) ALDH1A1ABCG2MAOBMAOALMNA
SCHEMBL20040969 0.78 SLC22A12 (0.55) SLC22A12
SCHEMBL8410422 0.75 ALDH1A1 (0.44) ALDH1A1ABCG2MAOBMAOALMNA
SCHEMBL16361132 0.75 ABCG2 (0.38) ALDH1A1ABCG2MAOBMAOALMNA
SCHEMBL21254454 0.75 PLA2G7 (0.37) ALDH1A1EGLN2LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718277-B1 Method for producing 5-substituted-2-acylaminophenols, and 5-alkyl-2-acylaminophenol compound and N-acyl-N-(4-alkyl-phenyl)hydroxylamine compound FUJI PHOTO FILM CO LTD (JP) 1999-07-21 EP disclosed
EP-0718277-A1 Method for producing 5-substituted-2-acylaminophenols, and 5-alkyl-2-acylaminophenol compound and N-acyl-N-(4-alkyl-phenyl)hydroxylamine compound FUJI PHOTO FILM CO., LTD. (JP) 1996-06-26 EP disclosed