SCHEMBL3215819

SCHEMBL3215819

Nc1ccc(-c2cccc(Oc3cc(=O)[nH]c4ccccc34)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
TNKS2 Q9H2K2 2/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
MCL1 Q07820 1/20 0.38
GRM5 P41594 1/20 0.37
XDH P47989 1/20 0.37
PARP1 P09874 1/20 0.37
MEN1 O00255 1/20 0.36
MITF O75030 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL3217295 0.91 HPGD (0.46) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL13429161 0.91 HPGD (0.54) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL13429118 0.90 HPGD (0.45) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL13429277 0.86 PTGS2 (0.48) KDM4EF2HSD17B10
SCHEMBL3224936 0.85 MAOB (0.47) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL13429082 0.85 CYP1A2 (0.47) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL13429184 0.85 GRIN2D (0.45) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL3209675 0.85 MAP4K4 (0.43) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL13429012 0.85 XDH (0.44) SMN1; SMN2HPGDMAPK1HTTTNKS2
SCHEMBL13429113 0.83 HPGD (0.57) SMN1; SMN2HPGDMAPK1HTTTNKS2

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
WO-2010030967-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS WYETH LLC (US) 2010-03-18 WO disclosed
US-20100068204-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS WYETH (US) 2010-03-18 US disclosed
US-20100068204-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS WYETH (US) 2010-03-18 US disclosed
US-20100068204-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS WYETH (US) 2010-03-18 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 (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-20100068204-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS MTOR, RICTOR, PIK3CA SMN1; SMN2 4072/4885HPGD 2472/4885MAPK1 283/4885

“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.