SCHEMBL10891718

SCHEMBL10891718

Cc1[nH]c(=O)ccc1-c1ccc(O)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.46
MAPT P10636 2/20 0.42
ADORA3 P0DMS8 2/20 0.40
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
PTGS2 P35354 1/20 0.39
NR1I2 O75469 1/20 0.39
ALOX5 P09917 2/20 0.38
MIF P14174 2/20 0.38
SNCA P37840 1/20 0.38
GUSB P08236 1/20 0.37
XDH P47989 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
QDPR P09417 1/20 0.37

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
SCHEMBL10887627 0.85 ALDH1A1 (0.42) MAPTGAA
SCHEMBL10888824 0.81 MAPT (0.52) MAPTXDHGAA
SCHEMBL7338278 0.80 ESR1 (0.42) GAA
SCHEMBL7331775 0.78 MAOA (0.43) MGAMGAASIMGAM2
SCHEMBL10992753 0.76 PDE3B (0.62) APPMAPTADORA3ADORA2AADORA1
SCHEMBL10890724 0.73 PDE3B (0.42) ADORA2AADORA1
SCHEMBL10995836 0.72 GAA (0.41) APPADORA3ADORA2AADORA1GUSB
SCHEMBL10891285 0.72 KDM4E (0.65) APPGAA
SCHEMBL11010732 0.72 PDE4A (0.53) MAPTGAA
SCHEMBL7318943 0.71 HPGD (0.49) MAPTGUSBMGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4599423-A Preparation of 5-(hydroxy- and/or aminophenyl-6-lower-alkyl)-2(1H)-pyridinones STERLING DRUG INC. (US) 1986-07-08 US claimed
US-4465686-A 5-(Hydroxy- and/or amino-phenyl)-6-(lower-alkyl)-2-(1H)-pyridinones, their cardiotonic use and preparation STERLING DRUG INC. (US) 1984-08-14 US claimed
EP-0074091-A2 2(1H)-pyridinones and preparation thereof STERLING DRUG INC. (US) 1983-03-16 EP claimed
US-4599423-A Preparation of 5-(hydroxy- and/or aminophenyl-6-lower-alkyl)-2(1H)-pyridinones STERLING DRUG INC. (US) 1986-07-08 US disclosed
US-4465686-A 5-(Hydroxy- and/or amino-phenyl)-6-(lower-alkyl)-2-(1H)-pyridinones, their cardiotonic use and preparation STERLING DRUG INC. (US) 1984-08-14 US disclosed
EP-0074091-A2 2(1H)-pyridinones and preparation thereof STERLING DRUG INC. (US) 1983-03-16 EP disclosed