SCHEMBL5757564

SCHEMBL5757564

O=C(c1ccc(Cl)cc1)c1ccc2nccc(C(=O)O)c2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
SRD5A2 P31213 3/20 0.49
MAPKAPK2 P49137 1/20 0.48
NR4A1 P22736 1/20 0.46
KDM4C Q9H3R0 3/20 0.45
PTGES O14684 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ALOX5 P09917 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
CASP7 P55210 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HTT P42858 1/20 0.42
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
MAPK1 P28482 1/20 0.41
DHODH Q02127 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL11669432 0.85 LMNA (0.60) LMNAKDM4CPTGESALDH1A1ALOX5
SCHEMBL5757121 0.84 MAPKAPK2 (0.45) SRD5A2MAPKAPK2HPGDHTTMAPK1
SCHEMBL10464811 0.83 LMNA (0.62) LMNAMAPKAPK2KDM4CALDH1A1HSD17B10
SCHEMBL22119874 0.82 MAPKAPK2 (0.60) LMNAMAPKAPK2KDM4CPTGESALDH1A1
SCHEMBL17025564 0.81 MAPKAPK2 (0.43) SRD5A2MAPKAPK2ALDH1A1HPGDHTT
SCHEMBL5757586 0.81 MAPKAPK2 (0.43) SRD5A2MAPKAPK2ALDH1A1HPGDHTT
SCHEMBL6862365 0.81 PIK3CA (0.51) SRD5A2MAPKAPK2NR4A1ALDH1A1HPGD
SCHEMBL5756614 0.81 SRD5A2 (0.46) SRD5A2MAPKAPK2NR4A1ALDH1A1HPGD
SCHEMBL5758369 0.80 MAPKAPK2 (0.43) SRD5A2MAPKAPK2HPGDHTTMAPK1
SCHEMBL22189718 0.79 LMNA (0.51) LMNAMAPKAPK2KDM4CPTGESALDH1A1

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-20060135769-A1 Farnesyl transferase inhibiting 4-heterocyclyl-quinoline and quinazoline derivatives ANGIBAUD PATRICK R 2006-06-22 US disclosed
EP-1351954-B1 FARNESYL TRANSFERASE INHIBITING 4-HETEROCYCLYL-QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2006-05-03 EP disclosed
US-20040067968-A1 Farnesyl transferase inhibiting 4-heterocyclyl quinoline and quinazoline JANSSEN PHARMACEUTICA, N.V. (BE) 2004-04-08 US disclosed
EP-1351954-A1 FARNESYL TRANSFERASE INHIBITING 4-HETEROCYCLYL-QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2003-10-15 EP disclosed
WO-2002051834-A1 FARNESYL TRANSFERASE INHIBITING 4-HETEROCYCLYL-QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2002-07-04 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 (2 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-20040067968-A1 Farnesyl transferase inhibiting 4-heterocyclyl quinoline and quinazoline FNTA, FNTB, ACAT2 LMNA 3478/4885SRD5A2 451/4885MAPKAPK2 1601/4885
US-20060135769-A1 Farnesyl transferase inhibiting 4-heterocyclyl-quinoline and quinazoline derivatives FNTA, FNTB, RABGGTB LMNA 2482/4885SRD5A2 941/4885MAPKAPK2 1214/4885

“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.