SCHEMBL841536

SCHEMBL841536

O=C(O)c1ccc2ncccc2n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
ALOX15 P16050 3/20 0.61
HPGD P15428 1/20 0.61
HSD17B10 Q99714 1/20 0.61
MGAM O43451 1/20 0.58
KDM4E B2RXH2 5/20 0.58
LMNA P02545 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.48
NAPRT Q6XQN6 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
TDP1 Q9NUW8 2/20 0.48
TSHR P16473 2/20 0.48
ACMSD Q8TDX5 1/20 0.48
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MCL1 Q07820 1/20 0.43
RAB9A P51151 1/20 0.42
CYP3A4 P08684 2/20 0.41

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
Hydrochloric Acid SCHEMBL27619882 0.98 ALDH1A1 (0.59) ALDH1A1ALOX15HPGDHSD17B10MGAM
SCHEMBL28149208 0.89 ALOX15 (0.50) ALDH1A1ALOX15HPGDHSD17B10MGAM
Benzamide SCHEMBL27821963 0.87 HSD17B10 (0.53) ALDH1A1ALOX15HPGDHSD17B10MGAM
SCHEMBL27829573 0.86 KDM4E (0.59) ALDH1A1ALOX15HPGDHSD17B10MGAM
Quinaldic Acid SCHEMBL22449357 0.84 MGAM (0.79) ALDH1A1ALOX15HPGDHSD17B10MGAM
SCHEMBL2175934 0.83 MGAM (0.64) ALDH1A1ALOX15HPGDHSD17B10MGAM
SCHEMBL20572033 0.83 ALDH1A1 (0.50) ALDH1A1ALOX15HPGDHSD17B10MGAM
SCHEMBL163181 0.83 ALDH1A1 (0.46) ALDH1A1ALOX15HPGDHSD17B10MGAM
SCHEMBL13781685 0.83 ALDH1A1 (0.46) ALDH1A1ALOX15HPGDHSD17B10MGAM
Quinaldic Acid SCHEMBL27607370 0.82 MGAM (0.77) ALDH1A1ALOX15HPGDHSD17B10MGAM

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 280 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107286182-A Novel oxazolidinone fluoro quinolone derivative and purposes 李靖 2017-10-24 CN claimed
CN-102395273-B Thienopyridine derivatives for the treatment and prevention of dengue virus infection SIGA TECHNOLOGIES INC 2015-05-20 CN claimed
US-8598175-B2 Heteroarylamide pyrimidone derivatives SANOFI (FR) 2013-12-03 US claimed
US-8592437-B2 Heteroarylamide pyrimidone compounds SANOFI (FR) 2013-11-26 US claimed
CN-101903339-B Substituted N-phenyl-bipyrrolidine carboxamides and their therapeutic use SANOFI AVENTIS 2012-06-27 CN claimed
US-8198287-B2 Substituted heteroaryl pyridopyrimidone derivatives SANOFI-AVENTIS (FR) 2012-06-12 US claimed
CN-102395273-A Thienopyridine derivatives for the treatment and prevention of dengue virus infection SIGA TECHNOLOGIES INC 2012-03-28 CN claimed
CN-101563328-B substituted heteroaryl Pyridopyrimidinone derivatives SANOFI AVENTIS 2012-03-14 CN claimed
CN-101679306-B Heteroaryl amide substituted pyrimidone derivatives for the treatment of neurodegenerative diseases SANOFI-AVENTIS (FR) 2011-12-28 CN claimed
CN-102083827-A Thiazolidine compounds as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD 2011-06-01 CN claimed
EP-0621788-A4 HEMOREGULATORY PEPTIDES. SMITHKLINE BEECHAM CORP (US) 1997-03-05 EP claimed
EP-0725651-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1996-08-14 EP claimed
EP-0701446-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1996-03-20 EP claimed
WO-1995011693-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1995-05-04 WO claimed
WO-1994027627-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1994-12-08 WO claimed
EP-0621788-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1994-11-02 EP claimed
CN-1077960-A HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORP (US) 1993-11-03 CN claimed
WO-1993013789-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1993-07-22 WO claimed
EP-0120832-B1 4-ALKYLINDOLONAPHTHYRIDINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM OMNICHEM Société anonyme (BE) 1987-04-29 EP claimed
EP-0120832-A1 4-Alkylindolonaphthyridines and pharmaceutical compositions containing them OMNICHEM Société anonyme (BE) 1984-10-03 EP claimed