SCHEMBL5777512

SCHEMBL5777512

CN(C)CCNC(=O)c1cc(-c2cccc(Cl)c2)c2cc(C(c3ccc(Cl)cc3)c3cncn3C)ccc2n1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.56
FNTB P49356 5/20 0.56
MALT1 Q9UDY8 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
KDR P35968 1/20 0.38
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
CSNK2A3 Q8NEV1 1/20 0.37
PGGT1B P53609 3/20 0.36
FYN P06241 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
MAOB P27338 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
SCHEMBL5780727 0.89 FNTA (0.57) FNTAFNTBPGGT1B
SCHEMBL5780654 0.88 FNTA (0.54) FNTAFNTBCSNK2A2CSNK2BCSNK2A1
SCHEMBL5782193 0.88 FNTA (0.54) FNTAFNTBPGGT1B
SCHEMBL5778849 0.87 FNTA (0.56) FNTAFNTBKDRPGGT1BALDH1A1
SCHEMBL5777043 0.86 FNTA (0.52) FNTAFNTBCSNK2A2CSNK2BCSNK2A1
SCHEMBL5783128 0.86 FNTA (0.66) FNTAFNTBPGGT1B
SCHEMBL5783326 0.85 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL5778767 0.85 FNTA (0.54) FNTAFNTBALDH1A1MAPK1
Hydrochloric Acid SCHEMBL5780158 0.84 FNTA (0.64) FNTAFNTBPGGT1B
SCHEMBL5779856 0.83 FNTA (0.54) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7053105-B2 Farnesyl transferase inhibiting quinoline and quinazoline derivatives as farnesyl transferase inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-30 US claimed
EP-1322635-B1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2006-03-22 EP claimed
US-20030203904-A1 Farnesyl transferase inhibiting quinoline and quinazoline derivatives as farnesyl transferase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2003-10-30 US claimed
EP-1322635-A1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-07-02 EP claimed
WO-2002024682-A1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2002-03-28 WO claimed
US-7053105-B2 Farnesyl transferase inhibiting quinoline and quinazoline derivatives as farnesyl transferase inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-30 US disclosed
EP-1322635-B1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2006-03-22 EP disclosed
US-20030203904-A1 Farnesyl transferase inhibiting quinoline and quinazoline derivatives as farnesyl transferase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2003-10-30 US disclosed
EP-1322635-A1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-07-02 EP disclosed
WO-2002024682-A1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS 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-20030203904-A1 Farnesyl transferase inhibiting quinoline and quinazoline derivatives as farnesyl transferase inhibitors FNTA, FNTB, RABGGTB FNTA 1/4885FNTB 2/4885MALT1 4092/4885

“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.