SCHEMBL605144

SCHEMBL605144

Cc1ccc(C(=O)O)c(C(=O)O)c1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
HAAO P46952 1/20 0.45
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NOTUM Q6P988 2/20 0.43
CYP3A4 P08684 2/20 0.41
KMT2A Q03164 2/20 0.41
MCL1 Q07820 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP2C9 P11712 1/20 0.41
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 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
SCHEMBL8879082 0.98 CYP1A2 (0.44) CYP1A2HAAOALDH1A1KDM4EHPGD
SCHEMBL27554808 0.89 HAAO (0.41) CYP1A2HAAOALDH1A1KDM4EHPGD
SCHEMBL3392120 0.87 TDP1 (0.48) ALDH1A1KDM4EHPGDHSD17B10NOTUM
SCHEMBL27693838 0.87 GABRP (0.40) CYP1A2HAAOALDH1A1KDM4EHPGD
SCHEMBL27515105 0.86 HAAO (0.39) CYP1A2HAAOALDH1A1KDM4EHPGD
SCHEMBL1988762 0.84 CYP1A2 (0.61) CYP1A2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL29445717 0.84 CYP1A2 (0.61) CYP1A2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22989 0.84 CYP1A2 (0.61) CYP1A2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL195882 0.84 CYP1A2 (0.44) CYP1A2HAAOALDH1A1KDM4EHPGD
SCHEMBL29400914 0.84 CYP1A2 (0.44) CYP1A2HAAOALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1567470-B1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2013-06-05 EP claimed
US-5276127-A Crosslinked polyester from polyfunctional acids and alcohols MITSUBISHI RAYON COMPANY LTD. (JP) 1994-01-04 US claimed
EP-0471302-A2 Polyester resin for toner MITSUBISHI RAYON CO., LTD (JP) 1992-02-19 EP claimed
EP-1890992-B1 AN ENRICHMENT PROCESS USING COMPOUNDS USEFUL IN A POLYESTER PROCESS GRUPO PETROTEMEX SA DE CV (MX) 2019-10-23 EP disclosed
EP-1888498-B1 A PROCESS TO PRODUCE AN ENRICHMENT FEED GRUPO PETROTEMEX SA DE CV (MX) 2019-06-26 EP disclosed
EP-1888497-B1 A PROCESS TO PRODUCE AN ENRICHED COMPOSITION THROUGH THE USE OF A CATALYST REMOVAL ZONE AND AN ENRICHMENT ZONE GRUPO PETROTEMEX SA DE CV (MX) 2019-04-17 EP disclosed
EP-2066612-B1 A PROCESS TO PRODUCE AN ENRICHMENT FEED GRUPO PETROTEMEX SA DE CV (MX) 2018-08-01 EP disclosed
US-10029973-B2 Optimized liquid-phase oxidation GROPO PETROTEMEX, S.A. DE C.V. (MX) 2018-07-24 US disclosed
US-20180072648-A1 OPTIMIZED LIQUID-PHASE OXIDATION GRUPO PETROTEMEX, S.A. DE C.V. (MX) 2018-03-15 US disclosed
EP-2316566-B1 Bubble column reactor for gas-liquid exchange reactions GRUPO PETROTEMEX SA DE CV (MX) 2017-11-22 EP disclosed
EP-1791800-B1 OPTIMIZED LIQUID-PHASE OXIDATION GRUPO PETROTEMEX SA DE CV (MX) 2017-11-01 EP disclosed
CN-1191063-C Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders GENENTECH INC (US) 2005-03-02 CN disclosed
EP-1338336-A1 CATALYSTS COMPRISING N-SUBSTITUTED CYCLIC IMIDES AND PROCESSES FOR PREPARING ORGANIC COMPOUNDS WITH THE CATALYSTS Daicel Chemical Industries, Ltd. (JP) 2003-08-27 EP disclosed
US-20030013603-A1 Catalyst comprising n-substituted cylic imides and processes for preparing organic compounds with the catalyst DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-01-16 US disclosed
CN-1342139-A Serine protease inhibitors GENENTECH INC (US) 2002-03-27 CN disclosed
CN-1295471-A Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders GENENTECH INC (US) 2001-05-16 CN disclosed
US-5276127-A Crosslinked polyester from polyfunctional acids and alcohols MITSUBISHI RAYON COMPANY LTD. (JP) 1994-01-04 US disclosed
EP-0471302-A2 Polyester resin for toner MITSUBISHI RAYON CO., LTD (JP) 1992-02-19 EP disclosed
CN-86103619-A The preparation method of the bicyclic pyrazolidinones that 7-replaces 1986-10-29 CN disclosed
CN-86102877-A The method for preparing bicyclic pyrazolidinones 1986-10-29 CN disclosed