SCHEMBL600044

SCHEMBL600044

CCCCC(NS(=O)(=O)c1ccccc1C)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 5/20 0.62
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
ITGA2 P17301 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.51
MMP9 P14780 9/20 0.50
MMP2 P08253 8/20 0.50
MMP8 P22894 5/20 0.50
MMP12 P39900 4/20 0.50
MMP14 P50281 4/20 0.50
ITGB3 P05106 1/20 0.50
ALDH1A1 P00352 1/20 0.48
CYP2C19 P33261 1/20 0.48
MMP13 P45452 1/20 0.45
ADAMTS4 O75173 1/20 0.45

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
SCHEMBL457771 0.87 MMP9 (0.65) ITGAVSLC1A3SLC1A2SLC1A1ITGA2
SCHEMBL3898279 0.86 ITGAV (0.67) ITGAVSLC1A3SLC1A2SLC1A1ITGA2
SCHEMBL599786 0.85 LMNA (0.51) ITGAVL3MBTL1MMP9MMP2MMP8
SCHEMBL1509337 0.85 ITGAV (0.63) ITGAVSLC1A3SLC1A2SLC1A1ITGA2
SCHEMBL1509340 0.85 ITGAV (0.63) ITGAVSLC1A3SLC1A2SLC1A1ITGA2
SCHEMBL5191279 0.83 MMP9 (0.64) MMP9MMP2MMP8MMP12MMP14
SCHEMBL599969 0.83 MMP9 (0.64) MMP9MMP2MMP8MMP12MMP14
SCHEMBL27692486 0.83 ITGAV (0.67) ITGAVSLC1A3SLC1A2SLC1A1ITGA2
SCHEMBL27737068 0.83 MMP9 (0.60) ITGAVSLC1A3SLC1A2SLC1A1ITGA2
SCHEMBL4595506 0.82 MMP9 (0.50) ITGAVMMP9MMP2MMP8MMP12

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115612368-A Dehydration type antirust transparent coating for aviation and preparation method thereof 广东润和新材料科技有限公司 2023-01-17 CN claimed
CN-115612368-A Dehydration type antirust transparent coating for aviation and preparation method thereof 广东润和新材料科技有限公司 2023-01-17 CN disclosed
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
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
US-20120040875-A1 Water-Based Hydraulic Fluids Comprising Dithio-Di(Aryl Carbolic Acids) CLARIANT FINANCE (BVI) LIMITED (VG) 2012-02-16 US disclosed
EP-0294687-B1 USE OF SULFONAMIDCARBOXYLIC ACID SALTS AS CORROSION INHIBITORS IN AQUEOUS SYSTEMS BASF Aktiengesellschaft (DE) 1993-09-22 EP disclosed
US-4911888-A Salt containing phenyl ring BASF AKTIENGESELLSCHAFT (DE) 1990-03-27 US disclosed
EP-0294687-A1 Use of sulfonamidcarboxylic acid salts as corrosion inhibitors in aqueous systems BASF Aktiengesellschaft (DE) 1988-12-14 EP 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 ITGAV 3827/4885SLC1A3 1126/4885SLC1A2 2078/4885

“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.