SCHEMBL8077771

SCHEMBL8077771

CCc1cc2ccc(/C=C/C(=O)OC)cc2nc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KMT2A Q03164 2/20 0.50
FDPS P14324 2/20 0.48
EPHX2 P34913 1/20 0.48
APP P05067 3/20 0.48
TTR P02766 2/20 0.48
ALDH1A1 P00352 3/20 0.46
PTPN1 P18031 1/20 0.46
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
TYR P14679 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
MAPT P10636 3/20 0.44
GAA P10253 2/20 0.44
HTT P42858 2/20 0.44
JAK2 O60674 1/20 0.44

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
SCHEMBL8077531 0.80 ALDH1A1 (0.41) KDM4EFDPSTTRALDH1A1GAA
SCHEMBL31571103 0.80 ALDH1A1 (0.41) KDM4EFDPSTTRALDH1A1GAA
SCHEMBL31571035 0.79 GRM1 (0.39) KDM4EKMT2AALDH1A1MAPTGAA
SCHEMBL16852821 0.75 APP (0.61) KDM4ESMN1; SMN2KMT2AFDPSEPHX2
SCHEMBL21620882 0.74 APP (0.69) KDM4ESMN1; SMN2KMT2AFDPSEPHX2
SCHEMBL8155372 0.73 GRM1 (0.50) KMT2AALDH1A1MAPTGAAHTT
SCHEMBL31571081 0.73 GRM1 (0.50) KMT2AALDH1A1MAPTGAAHTT
SCHEMBL26791222 0.73 KDM4E (0.60) KDM4ESMN1; SMN2KMT2AFDPSEPHX2
SCHEMBL30634278 0.73 KDM4E (0.60) KDM4ESMN1; SMN2KMT2AFDPSEPHX2
SCHEMBL28754816 0.73 APP (0.58) KDM4ESMN1; SMN2KMT2AFDPSEPHX2

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
US-8404713-B2 Quinolinone derivatives as PARP inhibitors JANSSEN PHARMACEUTICA NV (BE) 2013-03-26 US disclosed
US-8404713-B2 Quinolinone derivatives as PARP inhibitors JANSSEN PHARMACEUTICA NV (BE) 2013-03-26 US disclosed
US-20100222348-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-09-02 US disclosed
US-20100222348-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-09-02 US disclosed
WO-2009053373-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-04-30 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-20100222348-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS PARP1, PARP2, PARP11 KDM4E 1008/4885SMN1; SMN2 2658/4885KMT2A 312/4885

“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.