SCHEMBL497429

SCHEMBL497429

NC(=O)c1cccnc1CO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.53
ALDH1A1 P00352 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
KDM4E B2RXH2 4/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
SYK P43405 5/20 0.48
NAPRT Q6XQN6 1/20 0.44
MAPT P10636 3/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
AHR P35869 1/20 0.44
P2RX7 Q99572 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 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
SCHEMBL62707 0.85 PARP1 (0.50) PARP1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL5196284 0.85 PARP1 (0.53) PARP1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL1937751 0.85 PARP1 (0.53) PARP1ALDH1A1L3MBTL1KDM4EHPGD
Hydrochloric Acid SCHEMBL30786354 0.84 PARP1 (0.49) PARP1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL31439135 0.83 PARP1 (0.51) PARP1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL353231 0.83 KDM4E (0.55) PARP1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30011332 0.83 KDM4E (0.55) PARP1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30666151 0.83 PARP1 (0.51) PARP1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL3664193 0.83 PARP1 (0.51) PARP1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL3967245 0.83 PARP1 (0.51) PARP1ALDH1A1L3MBTL1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543408-A1 SOLUBILIZATION OF THIOPYRIDINONE COMPOUND AND COMPOSITION COMPRISING SAME L'OREAL (FR) 2025-04-30 EP claimed
WO-2024045013-A1 COMPOSITION FOR CARING FOR THE SKIN L'OREAL (FR) 2024-03-07 WO claimed
WO-2023248248-A1 SOLUBILIZATION OF THIOPYRIDINONE COMPOUND AND COMPOSITION COMPRISING SAME L'ORÉAL (FR) 2023-12-28 WO claimed
EP-2026651-A2 COMBINATION THERAPY WITH NON-SELECTIVE COX INHIBITORS TO PREVENT COX-RELATED GASTRIC INJURIES PHARMENA NORTH AMERICA INC. (CA) 2009-02-25 EP claimed
EP-1919466-A2 FORMULATIONS FOR TREATMENT OF LIPOPROTEIN ABNORMALITIES COMPRISING A STATIN AND A METHYLNICOTINAMIDE DERIVATIVE PHARMENA NORTH AMERICA INC. (CA) 2008-05-14 EP claimed
WO-2007103540-A2 COMBINATION THERAPY WITH NON-SELECTIVE COX INHIBITORS TO PREVENT COX-RELATED GASTRIC INJURIES PHARMENA NORTH AMERICA INC. (CA) 2007-09-13 WO claimed
WO-2007074406-A2 FORMULATIONS FOR TREATMENT OF LIPOPROTEIN ABNORMALITIES COMPRISING A STATIN A STATIN AND A METHYLNICOTINAMIDE DERIVATIVE PHARMENA NORTH AMERICA INC. (CA) 2007-07-05 WO claimed
WO-2004103286-A2 COMPOSITIONS OF A CYCLOOXYGENASE-2 SELECTIVE INHIBITOR AND A CHOLIMERGIC AGENT PHARMACIA CORPORATION (US) 2004-12-02 WO claimed
EP-0792146-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-09-03 EP claimed
WO-1997002028-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-01-23 WO claimed
CN-118084801-A Compounds and uses thereof 詹森药业有限公司 2024-05-28 CN disclosed
CN-118084800-A Compounds and uses thereof 詹森药业有限公司 2024-05-28 CN disclosed
CN-112312913-B Compounds and uses thereof 詹森药业有限公司 2024-03-08 CN disclosed
WO-2024045013-A1 COMPOSITION FOR CARING FOR THE SKIN L'OREAL (FR) 2024-03-07 WO disclosed
WO-2023134708-A1 THIAZOLOPYRIDYL AMIDE DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS BEIGENE , LTD. (KY) 2023-07-20 WO disclosed
EP-0792146-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-09-03 EP disclosed
WO-1997002028-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-01-23 WO disclosed
EP-0271059-B1 2-Methylthiomethyl-dihydropyridines, a process for their preparation and pharmaceutical compositions containing them BOEHRINGER MANNHEIM ITALIA (IT) 1993-10-20 EP disclosed
US-4971984-A Cardiovascular disorders, hypotensive agints BEEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) 1990-11-20 US disclosed
EP-0271059-A1 2-Methylthiomethyl-dihydropyridines, a process for their preparation and pharmaceutical compositions containing them BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1988-06-15 EP disclosed