SCHEMBL5565443

SCHEMBL5565443

N#Cc1cc(N)ccc1Oc1cccnc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.73
SMN1; SMN2 Q16637 2/20 0.73
CYP19A1 P11511 6/20 0.66
KDM4E B2RXH2 3/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
SLC22A12 Q96S37 1/20 0.44
HTT P42858 1/20 0.40
MKNK1 Q9BUB5 1/20 0.39
MAPK14 Q16539 1/20 0.39
GLA P06280 1/20 0.39

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
SCHEMBL5553314 0.82 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KDM4EUSP2LMNA
SCHEMBL3581554 0.80 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2CYP19A1LMNATDP1
SCHEMBL30390353 0.80 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2CYP19A1LMNATDP1
SCHEMBL875806 0.80 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2CYP19A1LMNATDP1
SCHEMBL14656098 0.80 SMN1; SMN2 (0.68) ALDH1A1SMN1; SMN2CYP19A1KDM4ELMNA
SCHEMBL522790 0.79 CYP19A1 (1.00) ALDH1A1SMN1; SMN2CYP19A1LMNATDP1
SCHEMBL5570382 0.79 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2CYP19A1KDM4EUSP2
SCHEMBL1871431 0.79 CYP3A4 (0.54) ALDH1A1SMN1; SMN2CYP19A1KDM4EUSP2
SCHEMBL1446655 0.78 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2CYP19A1KDM4ELMNA
SCHEMBL21191106 0.78 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2CYP19A1LMNATDP1

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 ALDH1A1 3782/4885SMN1; SMN2 4594/4885CYP19A1 801/4885

“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.