SCHEMBL728419

SCHEMBL728419

COc1ccc(N)cc1C(=O)NO

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
HDAC8 Q9BY41 4/20 0.50
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GFER P55789 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 1/20 0.45
ALOX5 P09917 1/20 0.45
GAA P10253 2/20 0.45
CTSD P07339 1/20 0.45
PYGL P06737 1/20 0.44
POLB P06746 1/20 0.43
KDM1A O60341 1/20 0.43
STAT3 P40763 1/20 0.43

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
SCHEMBL2915261 0.94 ALDH1A1 (0.59) ALDH1A1HDAC8HDAC1HDAC6CYP1A2
SCHEMBL655826 0.86 ALDH1A1 (0.53) ALDH1A1CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL728203 0.86 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2ALOX5GAA
Hydrochloric Acid SCHEMBL2553196 0.85 ALDH1A1 (0.51) ALDH1A1CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL570110 0.82 GAA (0.61) ALDH1A1MAPTHSD17B10LMNAGAA
SCHEMBL12144981 0.82 ALOX5 (0.49) ALDH1A1HDAC8HDAC1HDAC6ALOX5
SCHEMBL730002 0.82 HTR2A (0.51) HDAC8HDAC1HDAC6MAPTSMN1; SMN2
SCHEMBL7601782 0.81 ALOX5 (0.55) ALDH1A1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL2875409 0.81 ALDH1A1 (0.57) ALDH1A1HDAC8HDAC1HDAC6CYP1A2
Hydrochloric Acid SCHEMBL15488205 0.81 GAA (0.59) ALDH1A1MAPTHSD17B10LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116602950-A Methods of treating fibrosis 诺格拉制药有限公司 2023-08-18 CN claimed
US-20180065921-A1 METHODS OF TREATING FIBROSIS NOGRA PHARMA LIMITED (IE) 2018-03-08 US claimed
US-20150087708-A1 METHODS OF TREATING FIBROSIS NOGRA PHARMA LIMITED (IE) 2015-03-26 US claimed
EP-2811993-A2 METHODS OF TREATING FIBROSIS Nogra Pharma Limited (IE) 2014-12-17 EP claimed
WO-2013117744-A9 METHODS OF TREATING FIBROSIS NOGRA PHARMA LIMITED (IE) 2013-10-03 WO claimed
WO-2013117744-A2 METHODS OF TREATING FIBROSIS NOGRA PHARMA LIMITED (IE) 2013-08-15 WO claimed
CN-101243043-B Compounds and their salts specific to the PPAR receptors and the EGF receptors and their use in the medical field GIULIANI INT LTD 2013-03-20 CN claimed
EP-1910275-B1 COMPOUNDS AND THEIR SALTS SPECIFIC TO THE PPAR RECEPTORS AND THE EGF RECEPTORS AND THEIR USE IN THE MEDICAL FIELD NOGRA PHARMA LTD (IE) 2013-02-13 EP claimed
EP-2131829-B1 PPAR-gamma agonists for the induction of cationic antimicrobial peptide expression as immunoprotective stimulants GIULIANI INT LTD (IE) 2012-04-18 EP claimed
US-8138357-B2 Compounds and their salts specific to the PPAR receptors and the EGF receptors and their use in the medical field GIULIANI INTERNATIONAL LIMITED (IE) 2012-03-20 US claimed
CN-102264361-A Method for preventing or reducing carcinogenesis or oxidative stress 2011-11-30 CN claimed
US-20110288058-A1 Methods for Preventing or Reducing Colon Carcinogenesis NOGRA PHARMA LIMITED (IE) 2011-11-24 US claimed
US-20110152225-A1 PPAR-Gamma Agonists for the Induction of Cationic Antimicrobial Peptide Expression as Immunoprotective Stimulants NOGRA PHARMA LIMITED (IE) 2011-06-23 US claimed
CN-101969943-A Compounds for the selective treatment of the intestinal immunoinflammatory component of celiac disease GIULIANI INT LTD 2011-02-09 CN claimed
US-20100305077-A1 COMPOUNDS FOR THE SELECTIVE TREATMENT OF THE INTESTINAL IMMUNO-INFLAMMATORY COMPONENT OF THE CELIAC DISEASE NOGRA PHARMA LIMITED (IE) 2010-12-02 US claimed
US-20090118357-A1 Compounds and their salts specific to the PPAR receptors and the EGF receptors and their use in the medical field GIULIANI INTERNATIONAL LIMITED (IE) 2009-05-07 US claimed
CN-101243043-A Compounds and their salts specific to the PPAR receptors and the EGF receptors and their use in the medical field GIULIANI INT LTD (IE) 2008-08-13 CN claimed
US-11753365-B2 Methods of treating fibrosis NOGRA PHARMA LIMITED (IE) 2023-09-12 US disclosed
WO-1998005627-A1 BORONIC COMPOUND COMPLEXING REAGENTS AND HIGHLY STABLE COMPLEXES PROLINX, INC. (US) 1998-02-12 WO disclosed
WO-1998005629-A1 BORONIC COMPOUND COMPLEXING REAGENTS AND COMPLEXES PROLINX, INC. (US) 1998-02-12 WO 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 (7 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-20150087708-A1 METHODS OF TREATING FIBROSIS MMP1, MMP8, FABP2 ALDH1A1 664/4885HDAC8 815/4885HDAC1 609/4885
US-20090118357-A1 Compounds and their salts specific to the PPAR receptors and the EGF receptors and their use in the medical field EGFR, ERBB3, FGFR3 ALDH1A1 2287/4885HDAC8 2263/4885HDAC1 1645/4885
US-20100305077-A1 COMPOUNDS FOR THE SELECTIVE TREATMENT OF THE INTESTINAL IMMUNO-INFLAMMATORY COMPONENT OF THE CELIAC DISEASE SI, FABP2, NFKBIA ALDH1A1 2703/4885HDAC8 1704/4885HDAC1 1339/4885
US-20180065921-A1 METHODS OF TREATING FIBROSIS MMP1, MMP8, FABP2 ALDH1A1 664/4885HDAC8 815/4885HDAC1 609/4885
US-11753365-B2 Methods of treating fibrosis MMP1, MMP8, FABP2 ALDH1A1 664/4885HDAC8 815/4885HDAC1 609/4885
US-20110288058-A1 Methods for Preventing or Reducing Colon Carcinogenesis NQO1, NFE2L2, CYBB ALDH1A1 103/4885HDAC8 2979/4885HDAC1 1420/4885
US-20110152225-A1 PPAR-Gamma Agonists for the Induction of Cationic Antimicrobial Peptide Expression as Immunoprotective Stimulants PPARG, FABP2, PPARD ALDH1A1 983/4885HDAC8 2540/4885HDAC1 1297/4885

“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.