SCHEMBL5657976

SCHEMBL5657976

O=C(c1cccc(I)c1)c1ccc2[nH]c(=O)cc(-c3cccc(Cl)c3)c2c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
FNTA P49354 3/20 0.43
FNTB P49356 3/20 0.43
CHEK1 O14757 1/20 0.40
WEE1 P30291 1/20 0.40
ALOX15 P16050 2/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NUDT1 P36639 4/20 0.38
ALOX5 P09917 1/20 0.38
LMNA P02545 1/20 0.37
PDE4A P27815 1/20 0.37
PGR P06401 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 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
SCHEMBL5657749 0.92 MEN1 (0.52) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL5722642 0.90 MEN1 (0.52) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL1538310 0.88 MEN1 (0.59) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL6009577 0.82 MEN1 (0.49) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL5656275 0.81 MEN1 (0.48) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL4296470 0.81 MEN1 (0.42) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL5550240 0.80 MEN1 (0.49) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL7205333 0.80 MEN1 (0.49) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL5780432 0.78 RXFP1 (0.52) MEN1KMT2ARXFP1FNTAFNTB
SCHEMBL11947173 0.78 MEN1 (0.60) MEN1KMT2ARXFP1HPGDMAPK1

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-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 MEN1 887/4885KMT2A 1668/4885RXFP1 2024/4885

“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.