SCHEMBL5656095

SCHEMBL5656095

Cn1c(S)nnc1C(O)(c1ccc(I)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)nc1nnnn12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FNTA P49354 11/20 0.52
FNTB P49356 11/20 0.52
PGGT1B P53609 2/20 0.52
RORC P51449 2/20 0.32
CHEK1 O14757 1/20 0.31
LIMK1 P53667 1/20 0.31
MAPK14 Q16539 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL5658133 0.94 FNTA (0.58) FNTAFNTBPGGT1BRORCCHEK1
SCHEMBL5656457 0.89 FNTA (0.51) FNTAFNTBPGGT1BRORCCHEK1
SCHEMBL5656175 0.86 FNTA (0.56) FNTAFNTBPGGT1BRORCCHEK1
SCHEMBL5657529 0.83 FNTA (0.56) FNTAFNTBPGGT1BRORCCHEK1
SCHEMBL13501479 0.82 FNTA (0.71) FNTAFNTBPGGT1BRORC
SCHEMBL5655411 0.79 FNTA (0.46) FNTAFNTBPGGT1BCHEK1LIMK1
SCHEMBL14588523 0.78 FNTA (0.62) FNTAFNTBPGGT1BCHEK1LIMK1
SCHEMBL5657377 0.77 FNTA (0.57) FNTAFNTBPGGT1BCHEK1LIMK1
Hydrochloric Acid SCHEMBL5656686 0.77 FNTA (0.56) FNTAFNTBPGGT1BCHEK1LIMK1
SCHEMBL5656338 0.77 FNTA (0.69) FNTAFNTBPGGT1BCHEK1LIMK1

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 2 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

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 1/4885PGGT1B 83/4885

“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.