SCHEMBL526364

SCHEMBL526364

CCOC(=O)c1onc2c1C(C)(C)CC(=CN(C)C)C2=O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.37
KDM4E B2RXH2 5/20 0.37
HSD17B10 Q99714 5/20 0.37
MAPT P10636 3/20 0.37
POLB P06746 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TSHR P16473 2/20 0.37
ESR1 P03372 1/20 0.37
NR4A1 P22736 1/20 0.37
HPGD P15428 7/20 0.34
TDP2 O95551 2/20 0.32
USP2 O75604 1/20 0.30
GAA P10253 1/20 0.30
MAPK1 P28482 1/20 0.30
RECQL P46063 1/20 0.30
PARG Q86W56 1/20 0.30

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
SCHEMBL10092914 0.81 MAPT (0.40) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL14990334 0.81 MAPT (0.40) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL14990333 0.81 MAPT (0.40) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL525742 0.79 MAPT (0.41) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL525741 0.79 MAPT (0.41) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL4154446 0.77 CDK2 (0.46) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL4154444 0.77 CDK2 (0.46) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL526271 0.72 ALDH1A1 (0.34) ALDH1A1KDM4EHSD17B10MAPTMEN1
SCHEMBL10092913 0.71 TDP2 (0.40) ALDH1A1KDM4EHSD17B10MAPTPOLB
SCHEMBL14990271 0.71 TDP2 (0.40) ALDH1A1KDM4EHSD17B10MAPTPOLB

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-9333205-B2 Isoxazolo-quinazolines as modulators of protein kinase activity NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-05-10 US disclosed
EP-2598508-B1 ISOXAZOLO-QUINAZOLINES AS MODULATORS OF PROTEIN KINASE ACTIVITY NERVIANO MEDICAL SCIENCES SRL (IT) 2015-04-22 EP disclosed
US-20130143896-A1 ISOXAZOLO-QUINAZOLINES AS MODULATORS OF PROTEIN KINASE ACTIVITY NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-06-06 US disclosed
EP-2598508-A1 ISOXAZOLO-QUINAZOLINES AS MODULATORS OF PROTEIN KINASE ACTIVITY Nerviano Medical Sciences S.r.l. (IT) 2013-06-05 EP disclosed
WO-2012013557-A1 ISOXAZOLO-QUINAZOLINES AS MODULATORS OF PROTEIN KINASE ACTIVITY NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-02-02 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-20130143896-A1 ISOXAZOLO-QUINAZOLINES AS MODULATORS OF PROTEIN KINASE ACTIVITY CSNK1A1, RPS6KA1, CSNK2A1 ALDH1A1 3745/4885KDM4E 3816/4885HSD17B10 4409/4885

“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.