SCHEMBL599971

SCHEMBL599971

CCCCCC(=O)ONS(=O)(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.49
ALDH1A1 P00352 3/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.47
TBXA2R P21731 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
GHSR Q92847 1/20 0.44
MMP1 P03956 3/20 0.43
MMP7 P09237 3/20 0.43
MMP12 P39900 3/20 0.43
MMP13 P45452 3/20 0.43
ACE P12821 2/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
KAT6A Q92794 1/20 0.43
METAP2 P50579 1/20 0.42

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
SCHEMBL10687684 0.89 ALDH1A1 (0.45) EPHX2ALDH1A1GAAHPGDTSHR
SCHEMBL6940566 0.87 ALDH1A1 (0.55) ALDH1A1GAATSHRMEN1KMT2A
SCHEMBL27454865 0.84 ATM (0.49) ALDH1A1KAT6A
SCHEMBL27480505 0.84 FBP1 (0.52) EPHX2
SCHEMBL7652696 0.83 ALDH1A1 (0.42) EPHX2ALDH1A1GAAHPGDTSHR
SCHEMBL7053278 0.83 BCAT1 (0.46) ALDH1A1GAATSHRMEN1KMT2A
SCHEMBL29114525 0.82 ALDH1A1 (0.56) ALDH1A1GAATSHRMEN1KMT2A
SCHEMBL8707459 0.82 ALDH1A1 (0.53) ALDH1A1MEN1KMT2A
SCHEMBL28226360 0.82 P2RX7 (0.43) ALDH1A1TBXA2RCES2CES1KAT6A
SCHEMBL27429775 0.80 FBP1 (0.53) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759264-B2 Water-based hydraulic fluids comprising dithio-di(aryl carbolic acids) CLARIENT FINANCE (BVI) LIMITED (VG) 2014-06-24 US claimed
EP-2379687-B1 WATER-BASED HYDRAULIC FLUIDS COMPRISING DITHIO-DI(ARYL CARBOLIC ACIDS) CLARIANT FINANCE BVI LTD (VG) 2013-04-24 EP claimed
US-20120040875-A1 Water-Based Hydraulic Fluids Comprising Dithio-Di(Aryl Carbolic Acids) CLARIANT FINANCE (BVI) LIMITED (VG) 2012-02-16 US claimed
CN-102197120-A Water-based hydraulic fluids comprising dithio-di(aryl carbolic acids) CLARIANT INT LTD 2011-09-21 CN claimed
US-9068137-B2 Water-mixed metal working fluids containing ether pyrrolidone carboxylic acids CLARIANT FINANCE (BVI) LIMITED (VG) 2015-06-30 US disclosed
US-8759264-B2 Water-based hydraulic fluids comprising dithio-di(aryl carbolic acids) CLARIENT FINANCE (BVI) LIMITED (VG) 2014-06-24 US disclosed
CN-102395660-B Polyalkylene glycol-based ether pyrrolidone carboxylic acids, and concentrates for the production of synthetic cooling lubricants containing the same CLARIANT INT LTD 2013-08-14 CN disclosed
CN-102369267-B Water-mixed metalworking fluids containing ether pyrrolidone carboxylic acids CLARIANT INT LTD 2013-06-12 CN disclosed
US-20120088706-A1 WATER-MIXED METAL WORKING FLUIDS CONTAINING ETHER PYRROLIDONE CARBOXYLIC ACIDS CLARIANT FINANCE (BVI) LIMITED (VG) 2012-04-12 US disclosed
US-20120088705-A1 POLYALKYLENE GLYCOL-BASED ETHER PYRROLIDONE CARBOXYLIC ACIDS, AND CONCENTRATES FOR THE PRODUCTION OF SYNTHETIC COOLING LUBRICANTS CONTAINING THE SAME CLARIANT FINANCE (BVI) LIMITED (VG) 2012-04-12 US disclosed
CN-102395660-A Polyalkylene glycol-based ether pyrrolidone carboxylic acids, and concentrates for the production of synthetic cooling lubricants containing the same CLARIANT INT LTD 2012-03-28 CN disclosed
CN-102369267-A Water-mixed metalworking fluids containing ether pyrrolidone carboxylic acids CLARIANT INT LTD 2012-03-07 CN disclosed
US-4889938-A CORROSION AND WEAR RESISTANCE; HIGH PRESSURE ADDITIVES FOR FUELS AND LUBRICANTS CIBA-GEIGY CORPORATION (US) 1989-12-26 US disclosed
US-4835310-A HIGH PRESSURE, ANTIWEAR ADDITIVES FOR FUNCTIONAL FLUIDS CIBA-GEIGY CORPORATION (US) 1989-05-30 US disclosed
US-4751324-A FOR METALS IN AQUEOUS SYSTEMS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1988-06-14 US disclosed
US-4693909-A ACRYLIC ACID-ETHYLENE COPOLYMER BASF AKTIENGESELLSCHAFT (DE) 1987-09-15 US disclosed
US-4563294-A Aqueous lubricant for saw chains HOECHST AKTIENGESELLSCHAFT (DE) 1986-01-07 US disclosed
US-4267122-A USEFUL AS CORROSION INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1981-05-12 US disclosed
US-4126634-A CORROSION INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1978-11-21 US disclosed
US-4060522-A ANTICORROSIVE BASF AKTIENGESELLSCHAFT (DT) 1977-11-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120088705-A1 POLYALKYLENE GLYCOL-BASED ETHER PYRROLIDONE CARBOXYLIC ACIDS, AND CONCENTRATES FOR THE PRODUCTION OF SYNTHETIC COOLING LUBRICANTS CONTAINING THE SAME F12, ADH1A, ADH1C EPHX2 1066/4885ALDH1A1 241/4885GAA 2347/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.