SCHEMBL5735396

SCHEMBL5735396

CC(=O)Nc1cc(C)c(OC(C)=O)cc1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.44
LMNA P02545 5/20 0.44
CASP1 P29466 4/20 0.44
GAA P10253 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK1 P28482 2/20 0.44
HTT P42858 2/20 0.44
TP53 P04637 2/20 0.44
MEN1 O00255 1/20 0.44
S1PR2 O95136 1/20 0.44
HSP90AA1 P07900 1/20 0.44
HSP90AB1 P08238 1/20 0.44
THRB P10828 1/20 0.44
ALOX15 P16050 1/20 0.44
RECQL P46063 1/20 0.44
MAPK10 P53779 1/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL5416042 0.81 MAPT (0.50) HSD17B10LMNACASP1GAASMN1; SMN2
SCHEMBL27118919 0.81 ALDH1A1 (0.55) LMNAGAASMN1; SMN2MAPTKMT2A
SCHEMBL5734883 0.77 GAA (0.47) HSD17B10LMNACASP1GAASMN1; SMN2
SCHEMBL11183137 0.76 KMT2A (0.48) HSD17B10LMNACASP1GAASMN1; SMN2
SCHEMBL9203846 0.76 ALDH1A1 (0.39) HSD17B10LMNAGAASMN1; SMN2MAPK1
SCHEMBL9299422 0.75 ALDH1A1 (0.41) LMNAGAASMN1; SMN2NPSR1MAPT
SCHEMBL16421474 0.75 ALDH1A1 (0.50) HSD17B10CASP1GAASMN1; SMN2MAPT
SCHEMBL9191286 0.74 MEN1 (0.54) HSD17B10LMNACASP1GAASMN1; SMN2
SCHEMBL28477572 0.73 ALDH1A1 (0.54) HSD17B10LMNASMN1; SMN2MAPTKMT2A
SCHEMBL5085232 0.71 MEN1 (0.57) HSD17B10LMNACASP1GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060189804-A1 Synthetic method for the preparation of quinazolin-4-one derivative BTG INTERNATIONAL LIMITED (GB) 2006-08-24 US disclosed
EP-1675831-A2 SYNTHETIC METHOD FOR THE PREPARATION OF QUINAZOLIN-4-ONE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 2006-07-05 EP disclosed
WO-2005012260-A2 SYNTHETIC METHOD FOR THE PREPARATION OF QUINAZOLIN-4-ONE DERIVATIVE BTG INTERNATIONAL LIMITED (GB) 2005-02-10 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-20060189804-A1 Synthetic method for the preparation of quinazolin-4-one derivative CYP4F3, CYP3A4, CYP4F11 HSD17B10 2071/4885LMNA 2952/4885CASP1 1377/4885

“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.