SCHEMBL6979772

SCHEMBL6979772

CC(C)=NOCC(=O)NCCOS(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MMP9 P14780 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.32
FAAH O00519 1/20 0.31
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 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
SCHEMBL6960984 0.78
SCHEMBL6980315 0.76 LMNA (0.41) LMNASMN1; SMN2USP2ALDH1A1HPGD
SCHEMBL17740185 0.76 FAAH (0.43) LMNASMN1; SMN2KDM4EALDH1A1MMP9
SCHEMBL11398723 0.74 MEN1 (0.50) LMNAKDM4EUSP2ALDH1A1MMP9
SCHEMBL3706965 0.74 ALDH1A1 (0.46) LMNASMN1; SMN2KDM4EUSP2ALDH1A1
SCHEMBL19704261 0.72 FAAH (0.60) LMNASMN1; SMN2L3MBTL1FAAH
SCHEMBL6979761 0.72 LGALS1 (0.44) LMNASMN1; SMN2ALDH1A1TSHRHPGD
SCHEMBL13934654 0.72 LMNA (0.47) LMNASMN1; SMN2KDM4ETSHRHPGD
SCHEMBL16120195 0.72 HSD17B10 (0.38) LMNAKDM4EUSP2ALDH1A1MMP9
SCHEMBL7371279 0.70 USP2 (0.46) LMNASMN1; SMN2KDM4EUSP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8349857-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2013-01-08 US disclosed
US-8202879-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-06-19 US disclosed
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-05-17 US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 US 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-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity ERBB2, EGFR, ABL1 LMNA 4634/4885SMN1; SMN2 4182/4885KDM4E 2805/4885
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY ERBB2, EGFR, ABL1 LMNA 4634/4885SMN1; SMN2 4182/4885KDM4E 2805/4885

“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.