SCHEMBL5565241

SCHEMBL5565241

COc1cc([N+](=O)[O-])ccc1Oc1cccnc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.60
LMNA P02545 2/20 0.60
SMN1; SMN2 Q16637 4/20 0.56
ALPL P05186 1/20 0.55
ALDH1A1 P00352 5/20 0.54
KMT2A Q03164 4/20 0.54
MAPT P10636 3/20 0.50
ATM Q13315 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MEN1 O00255 3/20 0.49
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TTR P02766 1/20 0.45

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
SCHEMBL1446664 0.85 LMNA (0.62) HTTLMNASMN1; SMN2ALPLALDH1A1
SCHEMBL2028774 0.85 LMNA (0.62) HTTLMNASMN1; SMN2ALPLALDH1A1
SCHEMBL29888811 0.85 LMNA (0.62) HTTLMNASMN1; SMN2ALPLALDH1A1
SCHEMBL3811331 0.83 MEN1 (0.59) HTTLMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL30222321 0.83 MEN1 (0.59) HTTLMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL30879375 0.83 MEN1 (0.62) HTTLMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL2644891 0.83 LMNA (0.62) HTTLMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL4033756 0.83 MEN1 (0.62) HTTLMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL6565639 0.82 MAPT (0.56) HTTLMNASMN1; SMN2ALPLALDH1A1
SCHEMBL5567177 0.82 KMT2A (0.51) HTTLMNASMN1; SMN2ALDH1A1KMT2A

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-20070232607-A1 Quinazoline Derivatives as Erbb Receptor Tyrosine kinases BRADBURY ROBERT H 2007-10-04 US disclosed
EP-1756088-A1 QUINAZOLINE DERIVATIVES AS ERBB RECEPTOR TYROSINE KINASES AstraZeneca AB (SE) 2007-02-28 EP disclosed
WO-2005118572-A1 QUINAZOLINE DERIVATIVES AS ERBB RECEPTOR TYROSINE KINASES ASTRAZENECA AB (SE) 2005-12-15 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-20070232607-A1 Quinazoline Derivatives as Erbb Receptor Tyrosine kinases ERBB2, ERBB3, ERBB4 HTT 3380/4885LMNA 3173/4885SMN1; SMN2 4594/4885

“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.