SCHEMBL3222479

SCHEMBL3222479

CC(C)(C)C(=O)Nc1ncccc1CNc1cccc(Oc2cc(=O)[nH]c3ccccc23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 1/20 0.41
BRAF P15056 11/20 0.38
KDR P35968 3/20 0.38
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
MAP2K7 O14733 1/20 0.37
GFER P55789 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALPG P10696 1/20 0.36
HPGD P15428 1/20 0.36
RAF1 P04049 1/20 0.36
LCK P06239 1/20 0.36
RET P07949 1/20 0.36
PDGFRB P09619 1/20 0.36
KIT P10721 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
SCHEMBL13429366 0.87 MEN1 (0.43) MEN1KMT2AGAABRAFKDR
SCHEMBL3217145 0.87 KMT2A (0.45) MEN1KMT2AGAAKDRMAPT
SCHEMBL13429313 0.82 GAA (0.53) MEN1KMT2AGAAMAPTNPSR1
SCHEMBL3214616 0.82 VCP (0.45) MEN1KMT2AGAABRAFMAPT
SCHEMBL13428972 0.82 GAA (0.44) MEN1KMT2AGAABRAFMAPT
SCHEMBL13429358 0.81 MEN1 (0.45) MEN1KMT2AGAAMAPTNPSR1
SCHEMBL13429256 0.78 MAOA (0.44) MEN1KMT2AGAABRAFMAPT
SCHEMBL13429262 0.75 F2 (0.46) MEN1KMT2AGAABRAFKDR
SCHEMBL3214639 0.74 SMN1; SMN2 (0.49) MEN1KMT2AGAABRAFMAPT
SCHEMBL13429316 0.74 KMT2A (0.52) MEN1KMT2AGAAMAPTNPSR1

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 6 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 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 claimed
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 MEN1 2648/4885KMT2A 2445/4885GAA 1227/4885

“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.