SCHEMBL5734883

SCHEMBL5734883

CC(=O)Nc1cc(C)c(OC(C)=O)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
CASP1 P29466 3/20 0.47
HSD17B10 Q99714 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 1/20 0.47
S1PR2 O95136 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HSP90AB1 P08238 1/20 0.47
THRB P10828 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
RECQL P46063 1/20 0.47
MAPK10 P53779 1/20 0.47
BLM P54132 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL5866566 0.85 ALDH1A1 (0.48) GAAKMT2AMAPTMEN1LMNA
SCHEMBL5416042 0.85 MAPT (0.50) GAACASP1HSD17B10KMT2AMAPT
SCHEMBL4978388 0.81 CA1 (0.50) GAAKMT2AMAPTHTTMEN1
SCHEMBL11183137 0.80 KMT2A (0.48) GAACASP1HSD17B10KMT2AMAPT
SCHEMBL2319917 0.79 CA1 (0.49) KMT2AMAPTHTTMEN1SMN1; SMN2
SCHEMBL17789260 0.79 ALDH1A1 (0.48) GAAHSD17B10KMT2AMAPTMEN1
SCHEMBL9191286 0.77 MEN1 (0.54) GAACASP1HSD17B10KMT2AMAPT
SCHEMBL7417048 0.77 SMN1; SMN2 (0.44) GAACASP1HSD17B10KMT2AMAPT
SCHEMBL5735396 0.77 HSD17B10 (0.44) GAACASP1HSD17B10KMT2AMAPT
SCHEMBL18750435 0.76 CA1 (0.56) HSD17B10MAPTHTTLMNASMN1; 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 GAA 2185/4885CASP1 1377/4885HSD17B10 2071/4885

“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.