SCHEMBL7679884

SCHEMBL7679884

CC[C@@H](NC(=O)c1cnc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cn3)ccc2c1)c1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 1/20 0.42
SMO Q99835 1/20 0.40
BRAF P15056 1/20 0.40
MTTP P55157 7/20 0.39
TRPV1 Q8NER1 4/20 0.39
PPARD Q03181 1/20 0.37
MCHR1 Q99705 1/20 0.37
PTGES O14684 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL6771609 0.93 SMO (0.47) TACR3SMOMTTPTRPV1
SCHEMBL6771082 0.90 HPGDS (0.42) SMOBRAFMTTPTRPV1MCHR1
SCHEMBL6769957 0.87 TRPV1 (0.41) SMOBRAFMTTPTRPV1
SCHEMBL6775259 0.86 TRPV1 (0.44) TACR3BRAFTRPV1EGLN1
SCHEMBL7925807 0.82 MTTP (0.53) MTTP
SCHEMBL6765643 0.82 TRPV1 (0.46) BRAFMTTPTRPV1PPARDMCHR1
SCHEMBL6769912 0.81 MAOB (0.52) BRAFTRPV1PTGES
SCHEMBL7920131 0.80 MTTP (0.48) SMOMTTPTRPV1
SCHEMBL6775048 0.79 HPGDS (0.44) MTTPTRPV1MCHR1
SCHEMBL6766297 0.78 MTTP (0.47) SMOMTTPTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 TACR3 2625/4885SMO 3658/4885BRAF 4186/4885

“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.