SCHEMBL537569

SCHEMBL537569

N[C@@H](Cc1ccoc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.58
PTGS1 P23219 3/20 0.58
PKM P14618 2/20 0.58
ALPI P09923 1/20 0.58
XIAP P98170 1/20 0.58
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
TPH1 P17752 2/20 0.53
ALOX15 P16050 3/20 0.50
HIF1A Q16665 3/20 0.50
HSD17B10 Q99714 2/20 0.50
KDM4E B2RXH2 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ALOX5 P09917 1/20 0.50
USP2 O75604 1/20 0.50
EGFR P00533 1/20 0.50
LCK P06239 1/20 0.50
FYN P06241 1/20 0.50
ADORA3 P0DMS8 1/20 0.50

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
SCHEMBL588601 1.00 SLC7A5 (0.58) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL537570 1.00 SLC7A5 (0.58) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL10927828 0.85 ALOX5 (0.50) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL7608944 0.82 SLC7A5 (0.56) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL7608948 0.82 SLC7A5 (0.56) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL6779373 0.78 SLC1A3 (0.44) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL2310526 0.78 SLC7A5 (0.83) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL2671472 0.76 CYP1A2 (0.46) PTGS1SLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL9812650 0.76
SCHEMBL23159186 0.74 SLC7A5 (1.00) SLC7A5PTGS1PKMALPIXIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434764-B2 Skin care compositions and methods comprising selective agonists of melanocortin 1 receptor UNIVERSITY OF CINCINNATI (US) 2016-09-06 US claimed
US-20150299251-A1 Skin Care Compositions and Methods Comprising Selective Agonists of Melanocortin 1 Receptor UNIVERSITY OF CINCINNATI (US) 2015-10-22 US claimed
US-20150297667-A1 PHARMACEUTICAL COMPOSITIONS AND THERAPEUTIC METHODS OF USE COMPRISING SELECTIVE AGONISTS OF MELANOCORTIN 1 RECEPTOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-22 US claimed
EP-2925340-A2 PHARMACEUTICAL COMPOSITIONS AND THERAPEUTIC METHODS OF USE COMPRISING SELECTIVE AGONISTS OF MELANOCORTIN 1 RECEPTOR University Of Cincinnati (US) 2015-10-07 EP claimed
EP-2922565-A2 SKIN CARE COMPOSITIONS AND METHODS COMPRISING SELECTIVE AGONISTS OF MELANOCORTIN 1 RECEPTOR University Of Cincinnati (US) 2015-09-30 EP claimed
WO-2014081846-A2 PHARMACEUTICAL COMPOSITIONS AND THERAPEUTIC METHODS OF USE COMPRISING SELECTIVE AGONISTS OF MELANOCORTIN 1 RECEPTOR UNIVERSITY OF CINCINNATI (US) 2014-05-30 WO claimed
WO-2014081845-A2 SKIN CARE COMPOSITIONS AND METHODS COMPRISING SELECTIVE AGONISTS OF MELANOCORTIN 1 RECEPTOR UNIVERSITY OF CINCINNATI (US) 2014-05-30 WO claimed
EP-1297826-A1 Nasal pharmaceutical compositions containing a NK-2 antagonist Menarini Ricerche S.p.A. (IT) 2003-04-02 EP claimed
EP-0815126-B1 BICYCLIC TACHYKININS ANTAGONISTS, PREPARATION THEREOF AND THEIR USE IN PHARMACEUTICAL COMPOSITION MENARINI FARMA IND (IT) 2001-01-03 EP claimed
US-6150325-A FOR TREATMENT OF ARTHRITIS, ASTHMA, INFLAMMATIONS, TUMORAL GROWTH, GASTROINTESTINAL HYPERMOTILITY, HUNTINGTON'S DISEASE, NEURITIS, NEURALGIA, HEMICRANIA, HYPERTENSION, URINARY INCONTINENCE, URTICARIA A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 2000-11-21 US claimed
WO-1996028467-A1 BICYCLIC TACHYKININS ANTAGONISTS, PREPARATION THEREOF AND THEIR USE IN PHARMACEUTICAL COMPOSITION A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1996-09-19 WO claimed
EP-0636146-A1 TACHYKININ ANTAGONIST TRICYCLIC COMPOUNDS, PREPARATION OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS. MENARINI FARMA IND (IT) 1995-02-01 EP claimed
EP-0276014-B1 Anticoagulant peptides MERRELL DOW PHARMA (US) 1994-08-31 EP claimed
EP-0255082-B1 Renin-inhibiting di- and tripeptides, methods for their production, drugs containing them, and their use HOECHST AG (DE) 1993-12-01 EP claimed
WO-1993021227-A1 TACHYKININ ANTAGONIST TRICYCLIC COMPOUNDS, PREPARATION OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1993-10-28 WO claimed
EP-0373549-B1 AMINO ACID DERIVATIVES WITH ENZYME-INHIBITING PROPERTIES, PROCESS TO SYNTHETISE THEM, COMPOSITION CONTAINING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1993-09-01 EP claimed
US-5204357-A RENIN-INHIBITING AMINO ACID DERIVATIVES HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-20 US claimed
EP-0394853-A1 Dipeptide-derivatives with enzym-inhibiting activity HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-31 EP claimed
EP-0394829-A1 Renin-inhibiting dipeptides, process to synthetize them, compositions containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-31 EP claimed
US-4855286-A HYPOTENSIVE AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-08 US claimed