SCHEMBL6160155

SCHEMBL6160155

COC(=O)c1cccc(CCC(=O)O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.71
CYP4A11 Q02928 3/20 0.71
LOXL2 Q9Y4K0 1/20 0.64
ALDH1A1 P00352 2/20 0.62
HPGD P15428 1/20 0.62
SLC7A5 Q01650 1/20 0.58
PPARG P37231 2/20 0.52
HIF1A Q16665 1/20 0.52
TSHR P16473 1/20 0.52
KEAP1 Q14145 1/20 0.52
MRGPRX4 Q96LA9 2/20 0.51
FOLH1 Q04609 1/20 0.51
MAPT P10636 2/20 0.50
RAB9A P51151 2/20 0.50
PTPRB P23467 1/20 0.50
CDC25A P30304 1/20 0.50
CDC25B P30305 1/20 0.50
PTEN P60484 1/20 0.50
PTPMT1 Q8WUK0 1/20 0.50
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL18540810 0.91 CYP4F2 (0.71) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL70173 0.88 CYP4F2 (0.83) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL14331821 0.87 CYP4F2 (0.71) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL1926802 0.87 CYP4F2 (0.76) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL23582699 0.86 CYP4F2 (0.69) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL11638638 0.84 CYP4F2 (0.69) CYP4F2CYP4A11ALDH1A1PPARGKEAP1
SCHEMBL10609527 0.83 CYP4F2 (0.76) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL1696378 0.83 CYP4F2 (0.76) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL46931 0.83 CYP4A11 (1.00) CYP4F2CYP4A11LOXL2ALDH1A1HPGD
SCHEMBL1492405 0.83 LOXL2 (0.68) CYP4F2CYP4A11LOXL2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050154011-A1 Tetrahydroisoquinolnyl sulfamic acids THE PROCTER & GAMBLE COMPANY 2005-07-14 US disclosed
EP-1178969-B1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2005-07-13 EP disclosed
WO-2004074256-A1 TETRAHYDROISOQUINOLINYL SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 WO disclosed
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed
EP-1178969-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2002-02-13 EP disclosed
WO-2000027823-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-18 WO disclosed
EP-0235452-B1 ORGANIC COMPOUNDS AND THEIR PHARMACEUTICAL USE LILLY INDUSTRIES LIMITED (GB) 1992-03-18 EP disclosed
US-4845110-A Organic compounds and their pharmaceutical use LILLY INDUSTRIES LIMITED (GB) 1989-07-04 US disclosed
EP-0235452-A2 Organic compounds and their pharmaceutical use LILLY INDUSTRIES LIMITED (GB) 1987-09-09 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-20050154011-A1 Tetrahydroisoquinolnyl sulfamic acids PTPRS, PTPRJ, PTPRM CYP4F2 631/4885CYP4A11 713/4885LOXL2 793/4885

“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.