SCHEMBL1574429

SCHEMBL1574429

CCC(C(=O)O)c1ccc(C(CC)C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 10/20 0.58
AKR1C2 P52895 10/20 0.58
PTGS1 P23219 2/20 0.58
AKR1C1 Q04828 1/20 0.58
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HTR1A P08908 1/20 0.50
ADRA1A P35348 1/20 0.50
LMNA P02545 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PTGS2 P35354 1/20 0.48
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
CYP2C19 P33261 2/20 0.45
CYP2C9 P11712 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL819392 0.91 LMNA (0.61) AKR1C3AKR1C2PTGS1AKR1C1ALDH1A1
SCHEMBL510548 0.91 ALDH1A1 (0.56) AKR1C3AKR1C2PTGS1AKR1C1ALDH1A1
SCHEMBL7705115 0.91 ALDH1A1 (0.56) AKR1C3AKR1C2PTGS1AKR1C1ALDH1A1
SCHEMBL67237 0.91 LMNA (0.59) ALDH1A1GAAHTR1AADRA1ALMNA
SCHEMBL65737 0.91 LMNA (0.59) ALDH1A1GAAHTR1AADRA1ALMNA
SCHEMBL29757088 0.91 LMNA (0.59) ALDH1A1GAAHTR1AADRA1ALMNA
SCHEMBL20769804 0.91 LMNA (0.59) ALDH1A1GAAHTR1AADRA1ALMNA
SCHEMBL1715 0.91 LMNA (0.59) ALDH1A1GAAHTR1AADRA1ALMNA
SCHEMBL25377657 0.89 KMT2A (0.53) AKR1C3AKR1C2PTGS1AKR1C1ALDH1A1
SCHEMBL6766 0.89 KMT2A (0.53) AKR1C3AKR1C2PTGS1AKR1C1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2036936-B1 OXYGEN-ABSORBING RESIN, OXYGEN-ABSORBING RESIN COMPOSITIONS AND OXYGEN-ABSORBING CONTAINERS TOYO SEIKAN GROUP HOLDINGS LTD (JP) 2018-06-06 EP disclosed
EP-1953180-B1 OXYGEN-ABSORBING RESIN, OXYGEN-ABSORBING RESIN COMPOSITION AND OXYGEN-ABSORBING CONTAINER TOYO SEIKAN KAISHA LTD (JP) 2016-04-06 EP disclosed
WO-2011050098-A2 COMPOSITIONS, METHODS AND USES FOR INHIBITION AND/OR TREATMENT OF INFLUENZA INFECTION THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2011-04-28 WO disclosed
WO-2011041325-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF VIRAL DISORDERS THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2011-04-07 WO disclosed
US-7842361-B2 Oxygen-absorbing resin, oxygen-absorbing resin compositions and oxygen-absorbing containers TOYO SEIKAN KAISHA, LTD. (JP) 2010-11-30 US disclosed
US-7807781-B2 Inhibitors of serine protease activity and their use in methods and compositions for treatment of viral infections THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2010-10-05 US disclosed
US-20100210528-A1 Compositions, methods and uses for inhibition and/or treatment of influenza infection SHAPIRO LELAND 2010-08-19 US disclosed
US-20100144630-A1 Compositions, methods and uses for inhibition and/or treatment of influenza infection SHAPIRO LELAND 2010-06-10 US disclosed
US-7696300-B2 Oxygen-absorbing resin, oxygen-absorbing resin composition and oxygen-absorbing container TOYO SEIKAN KAISHA, LTD. (JP) 2010-04-13 US disclosed
US-20100087619-A1 Oxygen-Absorbing Resin, Oxygen-Absorbing Resin Composition and Oxygen-Absorbing Container TOYO SEIKAN KAISHA, LTD. (JP) 2010-04-08 US disclosed
US-20060040867-A1 Inhibitors of serine protease activity and their use in methods and compositions for treatment of bacterial infections REGENTS OF THE UNIVERSITY OF COLORADO 2006-02-23 US disclosed
US-6849605-B1 Inhibitors of serine protease activity, methods and compositions for treatment of viral infections THE TRUSTEES OF UNIVERSITY TECHNOLOGY CORPORATION (US) 2005-02-01 US disclosed
WO-2000052034-A2 INHIBITORS OF SERINE PROTEASE ACTIVITY, METHODS AND COMPOSITIONS FOR TREATMENT OF VIRAL INFECTIONS THE TRUSTEES OF UNIVERSITY TECHNOLOGY CORPORATION (US) 2000-09-08 WO disclosed
EP-0618899-B1 AROMATIC ESTERS OF PHENYLENEDIALKANOATES AS INHIBITORS OF HUMAN NEUTROPHIL ELASTASE CORTECH INC (US) 1996-03-13 EP disclosed
US-5387672-A For use in oxygen-transporting fluids THE UNIVERSITY OF MARYLAND AT BALTIMORE (US) 1995-02-07 US disclosed
EP-0618899-A4 AROMATIC ESTERS OF PHENYLENEDIALKANOATES AS INHIBITORS OF HUMAN NEUTROPHIL ELASTASE. CORTECH INC (US) 1994-11-02 EP disclosed
EP-0618899-A1 AROMATIC ESTERS OF PHENYLENEDIALKANOATES AS INHIBITORS OF HUMAN NEUTROPHIL ELASTASE. CORTECH INC (US) 1994-10-12 EP disclosed
WO-1993011760-A1 AROMATIC ESTERS OF PHENYLENEDIALKANOATES AS INHIBITORS OF HUMAN NEUTROPHIL ELASTASE CORTECH, INC. (US) 1993-06-24 WO disclosed
US-5216022-A Antiischemic agents CORTECH, INC. (US) 1993-06-01 US disclosed
US-4141911-A REACTING DICARBOXYLIC ACID WITH MONOBASIC CHROMIC SALT, SURFACTANTS TOKYO SHIBAURA ELECTRIC CO., LTD. (JP) 1979-02-27 US disclosed