SCHEMBL12822263

SCHEMBL12822263

O=C(c1cccc(Cn2c(=O)[nH]c(=O)c3ccc(C(F)(F)F)cc32)c1)N1CCN(c2ncccn2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
TIPARP Q7Z3E1 1/20 0.52
PARP1 P09874 2/20 0.51
SLC6A7 Q99884 3/20 0.51
KDM4E B2RXH2 2/20 0.49
MGLL Q99685 2/20 0.49
NAMPT P43490 1/20 0.45
USP2 O75604 1/20 0.44
CYP2C9 P11712 1/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL29722532 1.00 HDAC1 (0.54) HDAC1HDAC8HDAC6TIPARPPARP1
SCHEMBL12822210 0.89 PARP1 (0.54) HDAC1HDAC8HDAC6PARP1SLC6A7
SCHEMBL30428120 0.87 PARP1 (0.54) PARP1SLC6A7KDM4EUSP2ALDH1A1
SCHEMBL15420958 0.87 PARP1 (0.54) PARP1SLC6A7KDM4EMGLLALDH1A1
SCHEMBL15420546 0.87 PARP1 (0.54) PARP1SLC6A7KDM4EUSP2ALDH1A1
SCHEMBL12821925 0.87 PARP1 (0.61) PARP1SLC6A7KDM4EMGLLALDH1A1
SCHEMBL30418027 0.87 PARP1 (0.61) PARP1SLC6A7KDM4EMGLLALDH1A1
Hydrochloric Acid SCHEMBL15420661 0.86 PARP1 (0.61) PARP1SLC6A7KDM4EMGLLALDH1A1
SCHEMBL12822619 0.85 PARP1 (0.54) HDAC1HDAC8HDAC6PARP1SLC6A7
SCHEMBL12822699 0.85 ALDH1A1 (0.60) PARP1SLC6A7KDM4EUSP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230263801-A1 COMBINATION THERAPY OF PARP INHIBITORS Impact Therapeutics (Shanghai), Inc (CN) 2023-08-24 US claimed
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 claimed
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 claimed
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 claimed
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 claimed
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 claimed
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 claimed
US-20230263801-A1 COMBINATION THERAPY OF PARP INHIBITORS Impact Therapeutics (Shanghai), Inc (CN) 2023-08-24 US 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

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 HDAC1 117/4885HDAC8 453/4885HDAC6 610/4885
US-20230263801-A1 COMBINATION THERAPY OF PARP INHIBITORS PARP2, PARP1, PARP3 HDAC1 309/4885HDAC8 318/4885HDAC6 324/4885
US-10316027-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof PARP1, PARP11, PARP3 HDAC1 102/4885HDAC8 439/4885HDAC6 542/4885
US-20160237070-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 HDAC1 117/4885HDAC8 453/4885HDAC6 610/4885
US-20180215741-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 HDAC1 102/4885HDAC8 439/4885HDAC6 542/4885
US-11358955-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof PARP1, PARP11, PARP3 HDAC1 117/4885HDAC8 453/4885HDAC6 610/4885
US-20140023642-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 HDAC1 110/4885HDAC8 481/4885HDAC6 590/4885

“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.