SCHEMBL6589975

SCHEMBL6589975

CC(C)(C)C(=O)OCn1cnc2ccccc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.53
RECQL P46063 1/20 0.53
MAPK10 P53779 1/20 0.53
LMNA P02545 3/20 0.53
RAB9A P51151 5/20 0.52
NPC1 O15118 3/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 1/20 0.49
ALOX12 P18054 1/20 0.49
KMT2A Q03164 3/20 0.49
STAT1 P42224 1/20 0.49
MEN1 O00255 2/20 0.48
POLB P06746 1/20 0.48
GAA P10253 3/20 0.48
HPGD P15428 2/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL9601170 0.84 TRPA1 (0.47) SMN1; SMN2LMNARAB9ANPC1MAPT
SCHEMBL5565180 0.84 TNF (0.43) SMN1; SMN2RECQLMAPK10LMNAHTT
SCHEMBL5500566 0.84 ESR1 (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL5493928 0.82 PRKCA (0.46) SMN1; SMN2LMNARAB9ANPC1HTT
SCHEMBL3056830 0.81 HSD17B13 (0.40) SMN1; SMN2RECQLMAPK10LMNANPC1
SCHEMBL9253194 0.81 LMNA (0.43) SMN1; SMN2RECQLMAPK10LMNA
SCHEMBL9252072 0.81 TNF (0.43) SMN1; SMN2RECQLMAPK10LMNA
SCHEMBL13646422 0.81 TNF (0.56) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL9366964 0.80 MMP13 (0.52) SMN1; SMN2RECQLMAPK10POLB
SCHEMBL11964120 0.80 SMN1; SMN2 (0.64) SMN1; SMN2LMNARAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492560-B2 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2013-07-23 US disclosed
US-8293902-B2 Quinazoline compounds ASTRAZENECA AB (SE) 2012-10-23 US disclosed
US-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors STOKES ELAINE S E (GB) 2012-08-02 US disclosed
US-20120046300-A1 Quinazoline Derivatives as Angiogenesis Inhibitors HENNEQUIN LAURENT FRANCOIS ANDRE (FR) 2012-02-23 US disclosed
US-7989460-B2 potent kinase insert domain-containing receptor (KDR) inhibitors with improved selectivity and pharmacokinetics; VEGF (vascular endothelial growth factor) inhibitors; cancer and rheumatoid arthritis; e.g. 7-(2-[4-(acetylmethyl)piperazin-1-yl]ethoxy)-6-methoxy-4-[(2-methyl-1H-indol-5-yl)oxy]quinazoline ASTRAZENECA AB (SE) 2011-08-02 US disclosed
US-20090156821-A1 Quinazoline compounds ASTRAZENECA AB 2009-06-18 US disclosed
US-20080058342-A1 Quinazoline Derivatives As Angiogenesis Inhibitors ASTRAZENECA AB (SE) 2008-03-06 US disclosed
US-20080027069-A1 Quinazoline compounds ASTRAZENECA AB 2008-01-31 US disclosed
US-7268230-B2 Quinazoline compounds ASTRAZENECA AB (SE) 2007-09-11 US disclosed
US-7262201-B1 For the manufacture of a medicament for use in the production of an antiangiogenic and/or vascular permeability reducing effect in warm-blooded animals ASTRAZENECA AB (SE) 2007-08-28 US disclosed
EP-1381599-A1 QUINAZOLINE DERIVATIVES Astrazeneca AB (SE) 2004-01-21 EP disclosed
EP-1332141-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2003-08-06 EP disclosed
EP-1326859-A1 QUINAZOLINE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY AstraZeneca AB (SE) 2003-07-16 EP disclosed
WO-2002030924-A9 QUINAZOLINE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY ASTRAZENECA AB (SE) 2003-05-22 WO disclosed
WO-2002085895-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-10-31 WO disclosed
WO-2002034744-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-05-02 WO disclosed
WO-2002030924-A1 QUINAZOLINE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY ASTRAZENECA AB (SE) 2002-04-18 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 (5 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-20080058342-A1 Quinazoline Derivatives As Angiogenesis Inhibitors VEGFA, KDR, FLT1 SMN1; SMN2 3704/4885RECQL 878/4885MAPK10 1659/4885
US-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors VEGFA, FLT1, KDR SMN1; SMN2 4479/4885RECQL 831/4885MAPK10 834/4885
US-20120046300-A1 Quinazoline Derivatives as Angiogenesis Inhibitors VEGFA, KDR, FLT1 SMN1; SMN2 3661/4885RECQL 933/4885MAPK10 1772/4885
US-20090156821-A1 Quinazoline compounds VEGFA, FLT4, FLT1 SMN1; SMN2 4040/4885RECQL 142/4885MAPK10 2943/4885
US-20080027069-A1 Quinazoline compounds VEGFA, FLT4, FLT1 SMN1; SMN2 4040/4885RECQL 142/4885MAPK10 2943/4885

“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.