SCHEMBL3221532

SCHEMBL3221532

O=c1cc(Oc2cccc(NCc3ccc(Cl)nc3)c2)c2ccccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
BRAF P15056 5/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK8 P45983 1/20 0.37
GRM5 P41594 1/20 0.37
PTK6 Q13882 1/20 0.37
CACNA1B Q00975 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
SCHEMBL3227033 0.89 MEN1 (0.40) GAAMEN1KMT2ABRAFCYP3A4
SCHEMBL13429368 0.89 MEN1 (0.42) GAAMEN1KMT2ABRAFGRM5
SCHEMBL13429319 0.87 MEN1 (0.45) GAAL3MBTL1KDM4EMEN1KMT2A
SCHEMBL13429362 0.86 CACNA1B (0.41) GAAKDM4EMEN1KMT2ABRAF
SCHEMBL3219003 0.85 BRAF (0.48) GAAKDM4EMEN1KMT2ABRAF
SCHEMBL13429372 0.84 MEN1 (0.39) GAAMAPTMEN1KMT2ABRAF
SCHEMBL3214639 0.84 SMN1; SMN2 (0.49) GAAL3MBTL1KDM4EMAPTMEN1
SCHEMBL3214363 0.84 CYP1A2 (0.44) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL13429262 0.83 F2 (0.46) GAAKDM4EMEN1KMT2ABRAF
SCHEMBL13429356 0.82 ABL1 (0.46) GAAMEN1KMT2ABRAFGRM5

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-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 claimed
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 GAA 1227/4885L3MBTL1 3076/4885KDM4E 728/4885

“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.