SCHEMBL5654465

SCHEMBL5654465

Cn1cncc1C(N)(c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc(=O)n2C

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 15/20 0.67
FNTB P49356 15/20 0.67
CYP3A4 P08684 5/20 0.63
PGGT1B P53609 3/20 0.60

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
(S)-Tipifarnib SCHEMBL30436988 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
Tipifarnib SCHEMBL29352433 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
(S)-Tipifarnib SCHEMBL4429738 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
Tipifarnib SCHEMBL29371885 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
Tipifarnib SCHEMBL94807 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
Tipifarnib SCHEMBL23633189 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
Tipifarnib SCHEMBL8097 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
Tipifarnib SCHEMBL21544535 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
Tipifarnib SCHEMBL22772860 0.91 FNTA (0.80) FNTAFNTBCYP3A4PGGT1B
SCHEMBL7166412 0.90 FNTA (0.69) FNTAFNTBCYP3A4PGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040048882-A1 Farnesyl transferase inhibiting 6-(substituted phenyl) Methy)-quinoline and quinazoline derinazoline derivaties JANSSEN-CILAG S.A. (FR) 2004-03-11 US claimed
US-7173040-B2 Farnesyl transferase inhibiting 6-[(substituted phenyl)methyl]-quinoline and quinazoline derinazoline derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2007-02-06 US disclosed
US-20040048882-A1 Farnesyl transferase inhibiting 6-(substituted phenyl) Methy)-quinoline and quinazoline derinazoline derivaties JANSSEN-CILAG S.A. (FR) 2004-03-11 US disclosed
EP-1322636-A1 FARNESYL TRANSFERASE INHIBITING 6- (SUBSTITUTED PHENYL)METHYL]-QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2003-07-02 EP disclosed
WO-2002024683-A1 FARNESYL TRANSFERASE INHIBITING 6-[(SUBSTITUTED PHENYL)METHYL]-QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2002-03-28 WO 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-20040048882-A1 Farnesyl transferase inhibiting 6-(substituted phenyl) Methy)-quinoline and quinazoline derinazoline derivaties FNTB, FNTA, CYP7A1 FNTA 2/4885FNTB 1/4885CYP3A4 71/4885

“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.