SCHEMBL6769495

SCHEMBL6769495

Cc1nc2cc(NC(=O)c3cc(C(F)(F)F)ccc3-c3ccccc3)ccc2cc1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 10/20 0.51
APOB P04114 2/20 0.45
MTTP P55157 2/20 0.45
OPRL1 P41146 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
PPARG P37231 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
S1PR1 P21453 1/20 0.42
S1PR3 Q99500 1/20 0.42
MPO P05164 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
SCHEMBL6769177 0.90 MTTP (0.55) APOBMTTPOPRL1ALDH1A1MAPT
SCHEMBL6771302 0.83 APOB (0.44) SORT1APOBMTTPOPRL1
SCHEMBL7550198 0.82 BRAF (0.47) SORT1APOBMTTPMAPT
SCHEMBL6770861 0.80 TRPV1 (0.53) SORT1
SCHEMBL6765645 0.79 MTTP (0.51) APOBMTTPMAPT
SCHEMBL7133291 0.78 NPC1 (0.56) APOB
SCHEMBL7086631 0.76 NPC1 (0.54) APOBMTTP
SCHEMBL7087379 0.76 RXFP1 (0.57) APOBMTTP
SCHEMBL6792746 0.75 PTGS1 (0.57) APOBMTTPCA12CA1CA2
SCHEMBL13198105 0.74 MAPK14 (0.51) S1PR1S1PR3

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 2 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

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 SORT1 2246/4885APOB 1/4885MTTP 6/4885

“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.