SCHEMBL5332369

SCHEMBL5332369

O=c1[nH]c(=O)c2cccc(O)c2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.50
PRKCA P17252 1/20 0.50
KDM4E B2RXH2 5/20 0.49
TDP1 Q9NUW8 1/20 0.49
PARP1 P09874 11/20 0.48
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
RAB9A P51151 1/20 0.44
BLM P54132 1/20 0.44
PARP15 Q460N3 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TNKS O95271 7/20 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
SCHEMBL7028410 0.77 PBRM1 (0.58) KDM4ETDP1PARP1CA12CA9
SCHEMBL13857874 0.76 PARP1 (0.48) KDM4ETDP1PARP1CA12CA9
SCHEMBL2731038 0.76 PARP1 (0.48) KDM4EPARP1CA12CA9HSD17B10
SCHEMBL21230721 0.76 PARP1 (0.48) KDM4ETDP1PARP1CA12CA9
SCHEMBL527840 0.76 FEN1 (0.50) KDM4EPARP1CA12CA9ALDH1A1
SCHEMBL2922284 0.76 DAO (0.60) KDM4EPARP1CA12CA9CYP1A2
SCHEMBL2919116 0.76 CHEK1 (0.53) KDM4EPARP1CA12CA9HPGD
SCHEMBL6199860 0.76 PARP1 (0.67) KDM4ETDP1PARP1CA12CA9
SCHEMBL11814599 0.75 AR (0.57) EGFRPRKCAKDM4ETDP1PARP1
SCHEMBL765025 0.75 KDM4E (0.42) EGFRPRKCAKDM4ETDP1PARP1

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974847-A 3- (1,2,3-triazole-4-yl) tetrahydroquinazoline-2,4-diketone derivative and preparation method and application thereof 中国药科大学 2023-04-18 CN disclosed
US-11358955-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2022-06-14 US disclosed
US-20190270732-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP Inhibitors and the Use Thereof IMPACT THERAPEUTICS, INC. (CN) 2019-09-05 US disclosed
EP-2709990-B1 1-((3-((1-Piperazinyl)carbonyl)phenyl)methyl)-2,4(1H,3H)-quinazolinedione derivatives as PARP inhibitors for treating cancer IMPACT THERAPEUTICS INC (CN) 2019-06-12 EP disclosed
US-10316027-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2019-06-11 US disclosed
US-20180215741-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof IMPACT THERAPEUTICS INC (CN) 2018-08-02 US disclosed
US-9926304-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2018-03-27 US disclosed
US-20160237070-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof IMPACT THERAPEUTICS, INC. (CN) 2016-08-18 US disclosed
US-9290460-B2 1-(Arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2016-03-22 US disclosed
EP-2709990-A1 1-(ARYLMETHYL)QUINAZOLINE-2,4(1H,3H)-DIONES AS PARP INHIBITORS AND THE USE THEREOF Impact Therapeutics, Inc. (CN) 2014-03-26 EP disclosed
US-20140023642-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP Inhibitors and the Use Thereof IMPACT THERAPEUTICS, INC. (CN) 2014-01-23 US disclosed
WO-2012130166-A1 1-(ARYLMETHYL)QUINAZOLINE-2,4(1H,3H)-DIONES AS PARP INHIBITORS AND THE USE THEREOF IMPACT THERAPEUTICS, INC. (CN) 2012-10-04 WO disclosed
CN-101919833-B Application of aromatic compounds in preparing Caspase 3 inhibitor UNIV JINAN 2012-01-11 CN disclosed
CN-101919833-A Application of aromatic compounds in preparing Caspase 3 inhibitor UNIV JINAN 2010-12-22 CN disclosed
JP-2007137818-A 8-HYDROXY-2,4(1H,3H)-QUINAZOLINEDIONE DERIVATIVE TAISHO PHARMACEUT CO LTD 2007-06-07 JP disclosed
US-20070123543-A1 Novel compounds ASTRAZENECA AB (SE) 2007-05-31 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 (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-20190270732-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 EGFR 2441/4885PRKCA 1643/4885KDM4E 737/4885
US-20070123543-A1 Novel compounds C1R, CHRM2, CHRM1 EGFR 1833/4885PRKCA 3074/4885KDM4E 899/4885
US-10316027-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof PARP1, PARP11, PARP3 EGFR 2388/4885PRKCA 1496/4885KDM4E 704/4885
US-20160237070-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 EGFR 2441/4885PRKCA 1643/4885KDM4E 737/4885
US-20180215741-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 EGFR 2388/4885PRKCA 1496/4885KDM4E 704/4885
US-11358955-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof PARP1, PARP11, PARP3 EGFR 2441/4885PRKCA 1643/4885KDM4E 737/4885
US-20140023642-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 EGFR 2279/4885PRKCA 1729/4885KDM4E 617/4885

“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.