SCHEMBL6772074

SCHEMBL6772074

COC(=O)c1cccc(OC)c1OCCC1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 4/20 0.48
KMT2A Q03164 3/20 0.48
HSD17B10 Q99714 2/20 0.48
MEN1 O00255 1/20 0.48
TSHR P16473 2/20 0.46
SCN9A Q15858 1/20 0.45
HPGD P15428 2/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
ATM Q13315 1/20 0.44
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HSP90AA1 P07900 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL6766288 0.89 SCN9A (0.48) ALDH1A1KDM4EKMT2AMEN1SCN9A
SCHEMBL6768887 0.87 ALDH1A1 (0.48) ALDH1A1KDM4EKMT2AHSD17B10MEN1
SCHEMBL6769221 0.86 ALDH1A1 (0.50) ALDH1A1KDM4EKMT2AHSD17B10MEN1
SCHEMBL6769869 0.85 CXCR2 (0.46) ALDH1A1KDM4EKMT2AHSD17B10MEN1
SCHEMBL6771073 0.85 ALDH1A1 (0.45) ALDH1A1KDM4EKMT2AHSD17B10MEN1
SCHEMBL4060124 0.81 POLB (0.49) ALDH1A1KDM4EKMT2AHSD17B10TSHR
SCHEMBL2988553 0.79 POLB (0.49) ALDH1A1KDM4EKMT2AHSD17B10TSHR
SCHEMBL6769548 0.77 SMN1; SMN2 (0.47) ALDH1A1KDM4EKMT2AHSD17B10TSHR
SCHEMBL6775946 0.76 HTT (0.52) ALDH1A1KDM4EKMT2AHSD17B10TSHR
SCHEMBL6766000 0.76 LMNA (0.52) ALDH1A1KDM4EKMT2AMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713489-B2 TREATMENT OF ATHEROSCLEROSIS, OBESITY, DIABETES, HYPERLIPIDEMIA, HYPERLIPOPROTEINEMIA, HYPERCHOLESTEROLEMIA, HYPERTRIGLYCERIDEMIA, HYPOALPHALIPOPROTEINEMIA, PANCREATITIS, MYOCARDIAL INFARCTION, STROKE, RESTENOSIS, OR SYNDROME X PFIZER INC 2004-03-30 US disclosed
US-20020132806-A1 7-[(4'-trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and methods of inhibiting the secretion of apolipoprotein B RUGGERI ROGER (US) 2002-09-19 US disclosed
US-6369075-B1 7[4′-trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and method of inhibiting the secretion of apolipoprotein B PFIZER, INC. 2002-04-09 US disclosed
EP-1099701-A1 7-[(4'-Trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and methods of inhibiting the secretion of apolipoprotein B Pfizer Products Inc. (US) 2001-05-16 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-20020132806-A1 7-[(4'-trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and methods of inhibiting the secretion of apolipoprotein B APOB, CETP, PNLIP ALDH1A1 752/4885KDM4E 3538/4885KMT2A 3250/4885

“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.