SCHEMBL8071245

SCHEMBL8071245

CCc1cc2c(OC)cc(CCl)cc2nc1OC

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.35
PTGS2 P35354 1/20 0.34
GRM1 Q13255 1/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
TTR P02766 1/20 0.33
STING1 Q86WV6 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ELANE P08246 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
P2RX7 Q99572 3/20 0.32
TNF P01375 1/20 0.32

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
SCHEMBL8078338 0.89 PDE4A (0.37) CRHR1PTGS2GRM1PDE3BPDE3A
SCHEMBL8084564 0.79 NQO2 (0.41) GRM1PDE3BPDE3ASTING1KDM4E
SCHEMBL8074487 0.77 ALDH1A1 (0.39) GRM1PDE3BPDE3ATTRKDM4E
SCHEMBL8151067 0.77 ALDH1A1 (0.46) GRM1TTRKDM4EALDH1A1
SCHEMBL8161360 0.76 LMNA (0.45) CRHR1GRM1STING1KDM4EALDH1A1
SCHEMBL13230278 0.72 KDM4E (0.34) GRM1PDE3BPDE3ASTING1KDM4E
SCHEMBL8076088 0.72 DRD4 (0.53) KDM4EALDH1A1HTT
SCHEMBL31571087 0.68 ALDH1A1 (0.44) PTGS2GRM1KDM4EALDH1A1
SCHEMBL8078111 0.68 ALDH1A1 (0.44) PTGS2GRM1KDM4EALDH1A1
SCHEMBL8070842 0.67 NQO2 (0.40) GRM1PDE3BPDE3AKDM4EELANE

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 CRHR1 3725/4885PTGS2 1507/4885GRM1 3148/4885

“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.