SCHEMBL503583

SCHEMBL503583

CCOC(=O)[C@@H](N)Cc1ccc(O)c([N+](=O)[O-])c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
GRM4 Q14833 3/20 0.49
MAPT P10636 3/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 2/20 0.45
APOBEC3G Q9HC16 1/20 0.45
ALOX15 P16050 2/20 0.43
HSD17B10 Q99714 2/20 0.43
USP2 O75604 2/20 0.43
EGFR P00533 1/20 0.43
LCK P06239 1/20 0.43
FYN P06241 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
PTGS1 P23219 1/20 0.43
HTR2A P28223 1/20 0.43
PTGS2 P35354 1/20 0.43
RECQL P46063 1/20 0.43
SLC7A5 Q01650 1/20 0.43
HIF1A Q16665 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL22972798 1.00 ALDH1A1 (0.58) ALDH1A1GRM4MAPTNPSR1KDM4E
Hydrochloric Acid SCHEMBL3813837 0.99 ALDH1A1 (0.60) ALDH1A1GRM4MAPTNPSR1KDM4E
Hydrochloric Acid SCHEMBL2787874 0.99 ALDH1A1 (0.60) ALDH1A1GRM4MAPTNPSR1KDM4E
SCHEMBL1376225 0.89 ALDH1A1 (0.48) ALDH1A1GRM4MAPTNPSR1KDM4E
SCHEMBL27623048 0.89 ALDH1A1 (0.48) ALDH1A1GRM4MAPTNPSR1KDM4E
SCHEMBL9450673 0.89 GRM4 (0.50) ALDH1A1GRM4MAPTNPSR1KDM4E
SCHEMBL22557986 0.88 ALDH1A1 (0.73) ALDH1A1GRM4MAPTNPSR1KDM4E
SCHEMBL11397934 0.88 ALDH1A1 (0.73) ALDH1A1GRM4MAPTNPSR1KDM4E
SCHEMBL6935540 0.88 ALDH1A1 (0.73) ALDH1A1GRM4MAPTNPSR1KDM4E
Hydrochloric Acid SCHEMBL6935538 0.87 ALDH1A1 (0.76) ALDH1A1GRM4MAPTNPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119424050-A Degradable valve frame and heart valve 元心科技(深圳)有限公司 2025-02-14 CN claimed
WO-2025026273-A1 DEGRADABLE VALVE STENT, VALVE STENT FOR PULMONARY ARTERIAL VALVE, PULMONARY ARTERIAL VALVE, AND HEART VALVE 元心科技(深圳)有限公司 2025-02-06 WO claimed
EP-3655036-B1 COMPOSITIONS FOR TREATING STRESS-RELATED DISORDERS HOFFMAN TECH LLC (US) 2024-09-04 EP claimed
US-11931329-B2 Compositions and methods for treating anxiety-related disorders YAMO PHARMACEUTICALS LLC (US) 2024-03-19 US claimed
US-20240024268-A1 Methods for Dopamine Modulation in Human Neurologic Diseases SACKNER BERNSTEIN JONATHAN (US) 2024-01-25 US claimed
US-20240016815-A1 COMPOSITIONS AND METHODS FOR MODULATING CANCER IN NON-HUMAN MAMMALS HOFFMAN TECHNOLOGIES LLC 2024-01-18 US claimed
US-11786496-B2 Composition and methods for treating intestinal hyperpermeability YAMO PHARMACEUTICALS LLC (US) 2023-10-17 US claimed
EP-4255920-A2 COMPOSITIONS AND METHODS FOR MODULATING CANCER IN NON-HUMAN MAMMALS Hoffman Technologies LLC (US) 2023-10-11 EP claimed
CN-116783212-A Compositions and methods for modulating cancer in non-human mammals 霍夫曼技术有限责任公司 2023-09-19 CN claimed
US-20230141609-A1 Methods of Treating Amyotrophic Lateral Sclerosis and Symptoms YAMO PHARMACEUTICALS LLC (US) 2023-05-11 US claimed
WO-2015061256-A1 HIGH-SPEED CENTRIFUGAL MIXING DEVICES AND METHODS OF USE TYME, INC. (US) 2015-04-30 WO claimed
US-20150111878-A1 COMPOSITIONS AND METHODS FOR TREATING INTESTINAL HYPERPERMEABILITY HOFFMAN STEVEN (US) 2015-04-23 US claimed
US-20150112116-A1 TYROSINE DERIVATIVES AND COMPOSITIONS COMPRISING THEM OXFORD FINANCE LLC, AS COLLATERAL AGENT 2015-04-23 US claimed
US-20150110735-A1 HIGH-SPEED CENTRIFUGAL MIXING DEVICES AND METHODS OF USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2015-04-23 US claimed
US-20150111937-A1 Compositions and Methods for Treating Intestinal Hyperpermeability YAMO PHARMACEUTICALS LLC 2015-04-23 US claimed
EP-2804599-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS Tyme, Inc. (US) 2014-11-26 EP claimed
WO-2013109610-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS HOFFMAN STEVEN (US) 2013-07-25 WO claimed
US-20130184214-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2013-07-18 US claimed
US-8481498-B1 Pharmaceutical compositions and methods OXFORD FINANCE LLC, AS COLLATERAL AGENT 2013-07-09 US claimed
EP-1594853-B1 METHOD FOR THE PRODUCTION OF BICYCLIC AROMATIC AMINO ACIDS AND INTERMEDIATE PRODUCTS THEREOF MERCK PATENT GMBH (DE) 2008-07-09 EP claimed