SCHEMBL3218684

SCHEMBL3218684

NC(=O)c1ccc(Oc2cc(=O)[nH]c3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 8/20 0.50
PARP15 Q460N3 3/20 0.47
ALDH1A1 P00352 3/20 0.47
PARP14 Q460N5 2/20 0.47
KMT2A Q03164 2/20 0.47
PARP16 Q8N5Y8 1/20 0.47
PARP11 Q9NR21 1/20 0.47
PARP4 Q9UKK3 1/20 0.47
KDM4E B2RXH2 5/20 0.47
HSD17B10 Q99714 2/20 0.47
F2 P00734 1/20 0.47
RHEB Q15382 1/20 0.47
TNKS2 Q9H2K2 2/20 0.46
TNKS O95271 1/20 0.46
PARP2 Q9UGN5 1/20 0.46
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL13429126 0.86 KDM4E (0.50) ALDH1A1KMT2AKDM4EHSD17B10F2
SCHEMBL13429082 0.83 CYP1A2 (0.47) ALDH1A1KMT2AKDM4EHSD17B10F2
SCHEMBL2008835 0.82 HPGD (0.54) ALDH1A1KMT2AKDM4EHSD17B10F2
SCHEMBL17009602 0.81 PARP10 (0.49) PARP10PARP15ALDH1A1PARP14KMT2A
SCHEMBL13429062 0.80 L3MBTL1 (0.60) ALDH1A1KMT2AKDM4EHSD17B10TNKS2
SCHEMBL13429066 0.80 KDM4E (0.50) ALDH1A1KMT2AKDM4EHSD17B10F2
SCHEMBL13429075 0.80 CYP1A2 (0.56) ALDH1A1KMT2AKDM4EHSD17B10F2
SCHEMBL13429113 0.80 HPGD (0.57) ALDH1A1KMT2AKDM4EHSD17B10F2
SCHEMBL13429212 0.80 CYP1A2 (0.47) ALDH1A1KMT2AKDM4EHSD17B10F2
SCHEMBL13429129 0.80 RHEB (0.50) ALDH1A1KMT2AKDM4ERHEBTNKS2

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 5 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
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 PARP10 1391/4885PARP15 1550/4885ALDH1A1 2884/4885

“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.