SCHEMBL727922

SCHEMBL727922

Nc1cc2c(c(C(=O)O)c1)OCC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.53
XDH P47989 2/20 0.41
SLC22A12 Q96S37 1/20 0.41
TDP1 Q9NUW8 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPT P10636 5/20 0.38
ALDH1A1 P00352 3/20 0.38
THRB P10828 2/20 0.38
RECQL P46063 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP3A4 P08684 2/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
APEX1 P27695 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL30573216 1.00 PARP1 (0.53) PARP1XDHSLC22A12TDP1MEN1
SCHEMBL13294905 0.85 PARP1 (0.51) PARP1XDHSLC22A12KDM4EMAPT
SCHEMBL15616865 0.85 PARP1 (0.51) PARP1XDHSLC22A12MAPTPTGS2
SCHEMBL12283527 0.79 PARP1 (0.53) PARP1XDHSLC22A12MAPTPTGS2
SCHEMBL1029688 0.79 MAPT (0.50) PARP1XDHSLC22A12TDP1MEN1
SCHEMBL30605390 0.79 PARP1 (0.76) PARP1XDHSLC22A12KDM4EMAPT
SCHEMBL7264853 0.79 PARP1 (0.49) PARP1XDHSLC22A12KDM4EMAPT
SCHEMBL29089219 0.79 PARP1 (0.76) PARP1XDHSLC22A12KDM4EMAPT
SCHEMBL4387990 0.79 HTR3A (0.51) PARP1XDHSLC22A12CYP3A4FABP4
SCHEMBL29555685 0.79 MAPT (0.50) PARP1XDHSLC22A12TDP1MEN1

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 84 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
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
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
US-20110288058-A1 Methods for Preventing or Reducing Colon Carcinogenesis NOGRA PHARMA LIMITED (IE) 2011-11-24 US claimed
EP-2355810-A2 METHODS FOR PREVENTING OR REDUCING CARCINOGENESIS OR OXIDATIVE STRESS Giuliani International Limited (IE) 2011-08-17 EP 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
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
EP-2222291-A2 COMPOUNDS FOR THE SELECTIVE TREATMENT OF THE INTESTINAL IMMUNO-INFLAMMATORY COMPONENT OF THE CELIAC DISEASE Giuliani International Limited (IE) 2010-09-01 EP claimed
WO-2010063470-A2 METHODS FOR PREVENTING OR REDUCING CARCINOGENESIS OR OXIDATIVE STRESS GIULIANI INTERNATIONAL LIMITED (IE) 2010-06-10 WO claimed
EP-2131829-A1 PPAR-GAMMA AGONISTS FOR THE INDUCTION OF CATIONIC ANTIMICROBIAL PEPTIDE EXPRESSION AS IMMUNOPROTECTIVE STIMULANTS Giuliani International Limited (IE) 2009-12-16 EP claimed
WO-2009080828-A2 COMPOUNDS FOR THE SELECTIVE TREATMENT OF THE INTESTINAL IMMUNO-INFLAMMATORY COMPONENT OF THE CELIAC DISEASE GIULIANI INTERNATIONAL LIMITED (IE) 2009-07-02 WO 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
WO-2008104557-A1 PPAR-GAMMA AGONISTS FOR THE INDUCTION OF CATIONIC ANTIMICROBIAL PEPTIDE EXPRESSION AS IMMUNOPROTECTIVE STIMULANTS GIULIANI INTERNATIONAL LIMITED (IE) 2008-09-04 WO claimed
US-11753365-B2 Methods of treating fibrosis NOGRA PHARMA LIMITED (IE) 2023-09-12 US disclosed
WO-2007010514-A2 COMPOUNDS AND THEIR SALTS SPECIFIC TO THE PPAR RECEPTORS AND THE EGF RECEPTORS AND THEIR USE IN THE MEDICAL FIELD GIULIANI INTERNATIONAL LIMITED (IE) 2007-01-25 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 PARP1 3886/4885XDH 517/4885SLC22A12 2632/4885
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 PARP1 4434/4885XDH 2540/4885SLC22A12 1999/4885
US-20100305077-A1 COMPOUNDS FOR THE SELECTIVE TREATMENT OF THE INTESTINAL IMMUNO-INFLAMMATORY COMPONENT OF THE CELIAC DISEASE SI, FABP2, NFKBIA PARP1 4775/4885XDH 3488/4885SLC22A12 1441/4885
US-20180065921-A1 METHODS OF TREATING FIBROSIS MMP1, MMP8, FABP2 PARP1 3886/4885XDH 517/4885SLC22A12 2632/4885
US-11753365-B2 Methods of treating fibrosis MMP1, MMP8, FABP2 PARP1 3886/4885XDH 517/4885SLC22A12 2632/4885
US-20110288058-A1 Methods for Preventing or Reducing Colon Carcinogenesis NQO1, NFE2L2, CYBB PARP1 876/4885XDH 233/4885SLC22A12 802/4885
US-20110152225-A1 PPAR-Gamma Agonists for the Induction of Cationic Antimicrobial Peptide Expression as Immunoprotective Stimulants PPARG, FABP2, PPARD PARP1 2013/4885XDH 2865/4885SLC22A12 2754/4885

“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.