SCHEMBL12822210

SCHEMBL12822210

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.54
KDM4E B2RXH2 3/20 0.52
CYP3A4 P08684 3/20 0.51
CYP1A2 P05177 3/20 0.51
CYP2D6 P10635 3/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
PTGS1 P23219 2/20 0.49
PTGS2 P35354 2/20 0.49
ALDH1A1 P00352 3/20 0.48
HPGD P15428 2/20 0.48
HSD17B10 Q99714 2/20 0.48
TSHR P16473 1/20 0.48
SLC6A7 Q99884 2/20 0.48
USP2 O75604 1/20 0.47

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
SCHEMBL12822619 0.93 PARP1 (0.54) PARP1KDM4ECYP3A4CYP1A2CYP2D6
SCHEMBL15420546 0.90 PARP1 (0.54) PARP1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL15420958 0.90 PARP1 (0.54) PARP1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL30428120 0.90 PARP1 (0.54) PARP1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL30418027 0.89 PARP1 (0.61) PARP1KDM4EPTGS1PTGS2ALDH1A1
SCHEMBL12821925 0.89 PARP1 (0.61) PARP1KDM4EPTGS1PTGS2ALDH1A1
SCHEMBL29722532 0.89 HDAC1 (0.54) PARP1KDM4ECYP2C9SMN1; SMN2HDAC1
SCHEMBL12822263 0.89 HDAC1 (0.54) PARP1KDM4ECYP2C9SMN1; SMN2HDAC1
Hydrochloric Acid SCHEMBL15420661 0.88 PARP1 (0.61) PARP1KDM4EPTGS1PTGS2ALDH1A1
SCHEMBL12822699 0.87 ALDH1A1 (0.60) PARP1KDM4ECYP3A4CYP2D6SMN1; SMN2

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 17 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
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
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 PARP1 1/4885KDM4E 737/4885CYP3A4 727/4885
US-20230263801-A1 COMBINATION THERAPY OF PARP INHIBITORS PARP2, PARP1, PARP3 PARP1 2/4885KDM4E 1340/4885CYP3A4 1904/4885
US-10316027-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof PARP1, PARP11, PARP3 PARP1 1/4885KDM4E 704/4885CYP3A4 797/4885
US-20160237070-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 PARP1 1/4885KDM4E 737/4885CYP3A4 727/4885
US-20180215741-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-Diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 PARP1 1/4885KDM4E 704/4885CYP3A4 797/4885
US-11358955-B2 1-(arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP inhibitors and the use thereof PARP1, PARP11, PARP3 PARP1 1/4885KDM4E 737/4885CYP3A4 727/4885
US-20140023642-A1 1-(Arylmethyl)quinazoline-2,4(1H,3H)-diones as PARP Inhibitors and the Use Thereof PARP1, PARP11, PARP3 PARP1 1/4885KDM4E 617/4885CYP3A4 751/4885

“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.