SCHEMBL460158

SCHEMBL460158

C=CCc1nc(N2CCCCC2)c2ccccc2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.58
L3MBTL1 Q9Y468 4/20 0.58
HSD17B10 Q99714 3/20 0.58
GLA P06280 2/20 0.58
GAA P10253 1/20 0.58
HPGD P15428 1/20 0.58
KDM4E B2RXH2 4/20 0.56
MAPK1 P28482 3/20 0.56
ATM Q13315 2/20 0.56
CTDSP1 Q9GZU7 1/20 0.56
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
ACP1 P24666 2/20 0.56
LMNA P02545 4/20 0.54
ALDH1A1 P00352 3/20 0.54
NPSR1 Q6W5P4 2/20 0.54
TP53 P04637 1/20 0.52
HTT P42858 1/20 0.52
MAPT P10636 2/20 0.51
TLR7 Q9NYK1 1/20 0.51

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
SCHEMBL4092268 0.81 L3MBTL1 (0.63) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL638412 0.81 L3MBTL1 (0.63) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL27492494 0.81 KMT2A (0.64) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL4084496 0.80 L3MBTL1 (0.60) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL637946 0.80 L3MBTL1 (0.60) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL4089423 0.77 NPY5R (0.59) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL7951223 0.76 SLC29A1 (0.41) TSHRL3MBTL1HSD17B10GAAHPGD
SCHEMBL4097334 0.75 KMT2A (0.61) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL1090785 0.74 L3MBTL1 (1.00) TSHRL3MBTL1HSD17B10GLAGAA
SCHEMBL1091130 0.74 L3MBTL1 (1.00) TSHRL3MBTL1HSD17B10GLAGAA

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10150757-B2 Quinazolinone derivatives as PARP inhibitors JANSSEN PHARMACEUTICA NV (BE) 2018-12-11 US disclosed
US-20170158673-A1 QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-06-08 US disclosed
US-9522905-B2 Quinazolinone derivatives as PARP inhibitors JANSSEN PHARMACEUTICA NV (BE) 2016-12-20 US disclosed
US-20160108020-A1 QUINAZOLINEDIONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2016-04-21 US disclosed
US-9255080-B2 Quinazolinedione derivatives as PARP inhibitors JANSSEN PHARMACEUTICA NV (BE) 2016-02-09 US disclosed
US-20140100239-A1 QUINAZOLINEDIONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-04-10 US disclosed
US-20140080835-A1 QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-03-20 US disclosed
US-8623872-B2 Quinazolinone derivatives as PARP inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-01-07 US disclosed
US-8623884-B2 Quinazolinedione derivatives as PARP inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-01-07 US disclosed
CN-1980899-B Quinazolinone derivatives as parp inhibitors JANSSEN PHARMACEUTICA NV 2013-07-24 CN disclosed
US-20080070915-A1 Poly(ADP-ribose)polymerase (PARP); ischemia, reperfusion injuries, neurological disorders, neuroprotectants, sensitizer for chemotherapy or radiotherapy, anticancer JANSSEN-CILAG (FR) 2008-03-20 US disclosed
US-20080039480-A1 Quinazolinedione Derivatives as Parp Inhibitors JANSSEN PHARMCEUTICA, NV (BE) 2008-02-14 US disclosed
CN-1980913-A Quinazolinedione derivatives as parp inhibitors JANSSEN PHARMACEUTICA NV (BE) 2007-06-13 CN disclosed
CN-1980899-A Quinazolinone derivatives as parp inhibitors JANSSEN PHARMACEUTICA NV (BE) 2007-06-13 CN disclosed
EP-1771422-A1 QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-11 EP disclosed
EP-1763518-A1 SUBSTITUTED 2-ALKYL QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-21 EP disclosed
EP-1763523-A1 QUINAZOLINEDIONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-21 EP disclosed
WO-2006003146-A1 QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-01-12 WO disclosed
WO-2006003148-A1 QUINAZOLINEDIONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-01-12 WO disclosed
WO-2006003150-A1 SUBSTITUTED 2-ALKYL QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-01-12 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 (7 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-20160108020-A1 QUINAZOLINEDIONE DERIVATIVES AS PARP INHIBITORS PARP1, PARP2, PARP3 TSHR 3025/4885L3MBTL1 2870/4885HSD17B10 1152/4885
US-20080039480-A1 Quinazolinedione Derivatives as Parp Inhibitors PARP1, PARP2, PARP3 TSHR 3025/4885L3MBTL1 2870/4885HSD17B10 1152/4885
US-10150757-B2 Quinazolinone derivatives as PARP inhibitors PARP1, PARP3, PARP2 TSHR 4087/4885L3MBTL1 1488/4885HSD17B10 2418/4885
US-20140080835-A1 QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS PARP1, PARP3, PARP2 TSHR 4087/4885L3MBTL1 1488/4885HSD17B10 2418/4885
US-20080070915-A1 Poly(ADP-ribose)polymerase (PARP); ischemia, reperfusion injuries, neurological disorders, neuroprotectants, sensitizer for chemotherapy or radiotherapy, anticancer PARP1, PARP2, PARP11 TSHR 3150/4885L3MBTL1 544/4885HSD17B10 2910/4885
US-20170158673-A1 QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS PARP1, PARP3, PARP2 TSHR 4087/4885L3MBTL1 1488/4885HSD17B10 2418/4885
US-20140100239-A1 QUINAZOLINEDIONE DERIVATIVES AS PARP INHIBITORS PARP1, PARP2, PARP3 TSHR 3025/4885L3MBTL1 2870/4885HSD17B10 1152/4885

“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.