SCHEMBL4419627

SCHEMBL4419627

CS(=O)(=O)c1ccc(O)c(C(=O)O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.68
HSD17B10 Q99714 4/20 0.68
KDM4E B2RXH2 3/20 0.68
HPGD P15428 3/20 0.68
LMNA P02545 1/20 0.66
CSNK2A1 P68400 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
POLB P06746 2/20 0.54
PTGS2 P35354 3/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA12 O43570 1/20 0.53
ALOX5 P09917 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53
CA14 Q9ULX7 1/20 0.53
CYP2C9 P11712 2/20 0.53
PTGS1 P23219 1/20 0.53
PHLPP2 Q6ZVD8 1/20 0.53

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
SCHEMBL30868512 1.00 ALDH1A1 (0.68) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL3991783 0.86 MCL1 (0.65) ALDH1A1HSD17B10KDM4EHPGDLMNA
Sulfosalicylic SCHEMBL29157636 0.85 ALDH1A1 (0.86) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL1042597 0.85 LMNA (0.61) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL1577295 0.85 LMNA (0.51) ALDH1A1HSD17B10KDM4EHPGDLMNA
SCHEMBL8962352 0.84 LMNA (0.70) ALDH1A1HSD17B10KDM4EHPGDLMNA
Sulfosalicylic SCHEMBL28150168 0.83 ALDH1A1 (0.89) ALDH1A1HSD17B10KDM4EHPGDCSNK2A1
SCHEMBL3527141 0.82 ALDH1A1 (0.70) ALDH1A1HSD17B10KDM4EHPGDCSNK2A1
Sulfosalicylic SCHEMBL6717073 0.82 ALDH1A1 (0.96) ALDH1A1HSD17B10KDM4EHPGDCSNK2A1
Sulfosalicylic SCHEMBL29364125 0.82 ALDH1A1 (0.96) ALDH1A1HSD17B10KDM4EHPGDCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3405477-B1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-06-07 EP disclosed
US-11072634-B2 Inhibitors of transglutaminases ZEDIRA GMBH (DE) 2021-07-27 US disclosed
US-20190322700-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2019-10-24 US disclosed
WO-2018122419-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2018-07-05 WO disclosed
EP-3342779-A1 INHIBITORS OF TRANSGLUTAMINASES Zedira GmbH (DE) 2018-07-04 EP disclosed
CN-1867554-B Piperazine with ortho-substituted phenyl and its use as GLYT1 inhibitors HOFFMANN LA ROCHE 2011-07-06 CN disclosed
US-7605163-B2 Benzoyl-piperazine derivatives HOFFMANN-LA ROCHE INC. (US) 2009-10-20 US disclosed
WO-2008098978-A2 BENZOFURAN COMPOUNDS USEFUL IN THE TREATMENT OF CONDITIONS MEDIATED BY THE ACTION OF PGE2 AT THE EP1 RECEPTOR GLAXO GROUP LIMITED (GB) 2008-08-21 WO disclosed
US-20080119486-A1 BENZOYL-PIPERAZINE DERIVATIVES JOLIDON SYNESE 2008-05-22 US disclosed
US-7319099-B2 Such as 1-{3-fluoro-4-[4-(2-isopropoxy-5-methanesulfonyl benzoyl)-piperazin-1-yl]-phenyl}-ethanone for treatment of psychoses, pain, neurodegenerative disfunction in memory and learning, schizophrenia, dementia, attention deficit disorders, or Alzheimer's disease HOFFMANN-LA ROCHE INC. (US) 2008-01-15 US disclosed
WO-1992009284-A1 2,6-METHANO-2H-1-BENZOXOCINCARBOXAMIDES AS 5-HT3-ANTAGONISTS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS), INC. (US) 1992-06-11 WO disclosed
WO-1991004738-A1 DIBENZOFURANCARBOXAMIDES RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-04-18 WO disclosed
US-4959485-A 5-HT3 ANTAGONISTS RORER PHARMACEUTICAL CORPORATION (US) 1990-09-25 US disclosed
US-4939132-A Novel 5-alkylsulfonylsalicylanilides and microbiocidal compositions for controlling the growth of microorganisms THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1990-07-03 US disclosed
US-4935511-A Nervous system, gastrointestinal disorders RORER PHARMACEUTICAL CORPORATION (US) 1990-06-19 US disclosed
WO-1989010364-A1 DIBENZOFURANCARBOXAMIDES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-11-02 WO disclosed
EP-0339950-A2 Dibenzofurancarboxamides, their use as pharmaceutical agents, a composition containing the same, and a process for the preparation thereof RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1989-11-02 EP disclosed
US-4863921-A Dibenzofurancarboxamides and their pharmaceutical compositions and methods RORER PHARMACEUTICAL CORPORATION (US) 1989-09-05 US disclosed
EP-0198366-A1 Novel 5-alkylsulfonylsalicylanlides and microbiocidal compositions for controlling the growth of microorganisms THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1986-10-22 EP disclosed
US-4006239-A Benzoic acid amides for mycobacterium infections BAYER AKTIENGESELLSCHAFT (DT) 1977-02-01 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 (3 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-20080119486-A1 BENZOYL-PIPERAZINE DERIVATIVES SLC1A2, SLC18A2, SLC6A7 ALDH1A1 1436/4885HSD17B10 2913/4885KDM4E 2701/4885
US-20190322700-A1 INHIBITORS OF TRANSGLUTAMINASES TGM2, TGM3, TGM1 ALDH1A1 1469/4885HSD17B10 1144/4885KDM4E 911/4885
US-11072634-B2 Inhibitors of transglutaminases TGM2, TGM3, TGM1 ALDH1A1 1469/4885HSD17B10 1144/4885KDM4E 911/4885

“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.