SCHEMBL4017548

SCHEMBL4017548

CCCc1c(O)ccc(C(=O)CC)c1O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.49
PPARG P37231 3/20 0.43
PPARA Q07869 3/20 0.43
CYSLTR2 Q9NS75 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
PRKCI P41743 1/20 0.41
PPARD Q03181 1/20 0.40
CTSD P07339 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HMGCR P04035 1/20 0.39
MCL1 Q07820 1/20 0.37

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
SCHEMBL27375877 0.88 TYR (0.45) HSP90AB1PPARAPOLBMEN1LMNA
SCHEMBL7044950 0.88 HPGD (0.49) CYSLTR2CYSLTR1MEN1LMNAMAPT
SCHEMBL11393041 0.86 MAPT (0.40) HSP90AB1PPARGPPARACYSLTR2CYSLTR1
SCHEMBL8957148 0.86 PRKCI (0.41) HSP90AB1PPARGPPARACYSLTR2CYSLTR1
SCHEMBL27711763 0.85 HSP90AB1 (0.56) HSP90AB1POLBMEN1LMNAMAPT
SCHEMBL8262764 0.84 HSP90AB1 (0.43) HSP90AB1PPARGPPARACYSLTR2CYSLTR1
SCHEMBL480388 0.84 CYP1A2 (0.50) PPARGPPARACYSLTR2CYSLTR1MEN1
SCHEMBL10726758 0.84 SELL (0.53) PPARGPPARALMNAMAPTHPGD
SCHEMBL30736074 0.84 CYP1A2 (0.50) PPARGPPARACYSLTR2CYSLTR1MEN1
SCHEMBL6358047 0.83 GRM2 (0.46) HSP90AB1MEN1LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105121395-A Method to improve 1,1,3-trichloropropene and/or 3,3,3-trichloropropene selectivity during the dehydrochlorination of 1,1,1,3-tetrachloropropane HONEYWELL INT INC 2015-12-02 CN disclosed
CN-102161653-A Chromanylurea compounds that inhibit vanilloid receptor subtype 1 (vr1) receptor and uses thereof ABBOTT LAB 2011-08-24 CN disclosed
CN-101534811-A Compounds with medicinal effects due to interaction with the glucocorticoid receptor ORGANON NV (NL) 2009-09-16 CN disclosed
CN-101443327-A Chromanylurea compounds that inhibit vanilloid receptor subtype 1(VR1) receptor and uses thereof ABBOTT LAB (US) 2009-05-27 CN disclosed
US-7495020-B2 2-aryloxy-2-arylalkanoic acids for diabetes and lipid disorders MERCK & CO., INC. (US) 2009-02-24 US disclosed
US-7495020-B2 2-aryloxy-2-arylalkanoic acids for diabetes and lipid disorders MERCK & CO., INC. (US) 2009-02-24 US disclosed
US-7495020-B2 2-aryloxy-2-arylalkanoic acids for diabetes and lipid disorders MERCK & CO., INC. (US) 2009-02-24 US disclosed
CN-1877879-A Barrier layer for an organic electronic device XEROX CORP (US) 2006-12-13 CN disclosed
US-7091230-B2 2-aryloxy-2-arylalkanoic acids for diabetes and lipid disorders MERCK & CO., INC. (US) 2006-08-15 US disclosed
US-20060122242-A1 2-Aryloxy-2-arylalkanoic acids for diabetes and lipid disorders MERCK SHARP & DOHME CORP. 2006-06-08 US disclosed
WO-1997027857-A1 ANTIDIABETIC AGENTS MERCK & CO., INC. (US) 1997-08-07 WO disclosed
WO-1997028115-A1 ANTIDIABETIC AGENTS MERCK & CO., INC. (US) 1997-08-07 WO disclosed
WO-1997028137-A1 HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS MERCK & CO., INC. (US) 1997-08-07 WO disclosed
CN-1035001-C Substituted phenyl phenol leukotriene antagonists LILLY CO ELI (US) 1997-05-28 CN disclosed
CN-1088906-A The phenyl phenol leukotriene antagonists that replaces LILLY CO ELI (US) 1994-07-06 CN disclosed
EP-0295882-B1 PROCESS FOR INTERMEDIATES TO LEUKOTRIENE ANTAGONISTS ELI LILLY AND COMPANY (US) 1991-08-21 EP disclosed
EP-0295882-A1 Process for intermediates to leukotriene antagonists ELI LILLY AND COMPANY (US) 1988-12-21 EP disclosed
US-4777299-A Process for leukotriene antagonists ELI LILLY AND COMPANY (US) 1988-10-11 US disclosed
EP-0028063-B1 PHENOL DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 1984-06-13 EP disclosed
EP-0028063-A1 Phenol derivatives, processes for their preparation and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1981-05-06 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-20060122242-A1 2-Aryloxy-2-arylalkanoic acids for diabetes and lipid disorders PPARA, PPARG, PPARD HSP90AB1 877/4885PPARG 2/4885PPARA 1/4885

“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.