SCHEMBL6769840

SCHEMBL6769840

CCCCCOc1ccccc1C(=O)Nc1ccc2cc(C(=O)OCC)cnc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.54
MLNR O43193 1/20 0.54
NR1I2 O75469 1/20 0.54
NR3C1 P04150 1/20 0.54
PGR P06401 1/20 0.54
ADRB2 P07550 1/20 0.54
CHRM2 P08172 1/20 0.54
ADRB1 P08588 1/20 0.54
HTR1A P08908 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
CHRM1 P11229 1/20 0.54
DRD2 P14416 1/20 0.54
ADRA2B P18089 1/20 0.54
ADRA2C P18825 1/20 0.54
CHRM3 P20309 1/20 0.54
CNR1 P21554 1/20 0.54
SLC6A2 P23975 1/20 0.54
NPY1R P25929 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54

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
SCHEMBL6766413 0.90 KMT2A (0.50) KMT2AMLNRNR1I2NR3C1PGR
SCHEMBL6769299 0.84 MAOB (0.48) KMT2AALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL6769892 0.84 RAB9A (0.52) KMT2AALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL6768968 0.84 F2R (0.55) KMT2AALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL6769309 0.83 LMNA (0.46) KMT2ACNR1ALDH1A1MAPTSMN1; SMN2
SCHEMBL6766186 0.82 MEN1 (0.51) KMT2AALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL6769856 0.82 RAB9A (0.54) KMT2AALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL6769278 0.80 MAPT (0.49) KMT2AALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL7687336 0.80 MAOB (0.52) KMT2AHTR2CALDH1A1MAPTSMN1; SMN2
SCHEMBL6776284 0.80 MEN1 (0.42) KMT2AALDH1A1MAPTSMN1; SMN2MEN1

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 KMT2A 3250/4885MLNR 383/4885NR1I2 157/4885

“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.