SCHEMBL852350

SCHEMBL852350

O=C1N=NC2c3ccccc3-c3cccc1c32

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 2/20 0.33
EDNRA P25101 2/20 0.33
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A2 P05177 1/20 0.31
MAPK1 P28482 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
NCOR2 Q9Y618 1/20 0.31
GPR3 P46089 1/20 0.31
HTR2A P28223 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL855337 0.79 MAOA (0.37) POLBMEN1KMT2AMAPK1HDAC3
SCHEMBL8011185 0.76 ALDH1A1 (0.46) EDNRBEDNRAPOLBMEN1KMT2A
Hydrochloric Acid SCHEMBL31290829 0.75 NOS1 (0.31) GPR3HTR2A
SCHEMBL2230905 0.75 MAPT (0.48) EDNRBEDNRAPOLBMEN1KMT2A
SCHEMBL7892212 0.74 ALDH1A1 (0.41) POLBMEN1KMT2AHTR2AALDH1A1
SCHEMBL8554351 0.71 ALDH1A1 (0.43) POLBMEN1KMT2AMAPK1ALDH1A1
SCHEMBL7248118 0.71 RAB9A (0.46) EDNRBEDNRAPOLBMEN1KMT2A
SCHEMBL7884961 0.71 MAOB (0.40) POLBMEN1KMT2AALDH1A1
SCHEMBL2182063 0.71 KMT2A (0.46) POLBMEN1KMT2AMAPK1ALDH1A1
SCHEMBL2203803 0.70 HPGD (0.36) MEN1KMT2ACYP1A2MAPK1HDAC4

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
EP-4376822-A1 TREATING CANCERS WITH COMBINATIONS OF PARP INHIBITOR AND ACYLFULVENES Lantern Pharma Inc. (US) 2024-06-05 EP disclosed
WO-2023010119-A1 TREATING CANCERS WITH COMBINATIONS OF PARP INHIBITOR AND ACYLFULVENES LANTERN PHARMA INC. (US) 2023-02-02 WO disclosed
US-11162095-B2 Use of a combination of Dbait molecule and PARP inhibitors to treat cancer INSTITUT CURIE (FR) 2021-11-02 US disclosed
US-20210322475-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE UAB RESEARCH FOUNDATION 2021-10-21 US disclosed
EP-3877514-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER In8bio, Inc. (US) 2021-09-15 EP disclosed
US-20210046072-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L KING'S COLLEGE LONDON (GB) 2021-02-18 US disclosed
US-10799501-B2 Combination of an inhibitor of PARP with an inhibitor of GSK-3 or DOT1L KING'S COLLEGE HOSPITAL NHS FOUNDATION TRUST (GB) 2020-10-13 US disclosed
US-20200172901-A1 USE OF A COMBINATION OF DBAIT MOLECULE AND PARP INHIBITORS TO TREAT CANCER VALERIO THERAPEUTICS (FR) 2020-06-04 US disclosed
US-10563197-B2 Use of a combination of Dbait molecule and PARP inhibitors to treat cancer INSTITUT CURIE (FR) 2020-02-18 US disclosed
US-20190076427-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L KING'S COLLEGE HOSPITAL NHS FOUNDATION TRUST (GB) 2019-03-14 US disclosed
US-20180362972-A1 USE OF A COMBINATION OF DBAIT MOLECULE AND PARP INHIBITORS TO TREAT CANCER VALERIO THERAPEUTICS (FR) 2018-12-20 US disclosed
EP-3370774-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L King's College London (GB) 2018-09-12 EP disclosed
WO-2017077326-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L KING'S COLLEGE LONDON (GB) 2017-05-11 WO disclosed
US-20160208339-A1 BIOMARKERS CORRELATED TO PARP INHIBITOR TREATMENT SUCCESS IN AML PATIENTS KING'S COLLEGE LONDON (GB) 2016-07-21 US disclosed
US-20120135983-A1 DNA Damage Repair Inhibitors for the Treatment of Cancer The Institute of Cancer Reseach 2012-05-31 US disclosed
US-8143241-B2 DNA damage repair inhibitors for treatment of cancer KUDOS PHARMACEUTICALS LIMITED (GB) 2012-03-27 US disclosed
US-20100249112-A1 COMBINATION OF CHK AND PARP INHIBITORS FOR THE TREATMENT OF CANCERS ASTRAZENECA R&D (SE) 2010-09-30 US disclosed
US-20030176454-A1 N-coating heterocyclic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-09-18 US disclosed
WO-2001087845-A2 N-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE AS 5-HT ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-11-22 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 (10 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-11162095-B2 Use of a combination of Dbait molecule and PARP inhibitors to treat cancer PARP10, PARP1, PARP3 EDNRB 2661/4885EDNRA 2421/4885POLB 291/4885
US-20200172901-A1 USE OF A COMBINATION OF DBAIT MOLECULE AND PARP INHIBITORS TO TREAT CANCER PARP10, PARP1, PARP3 EDNRB 2661/4885EDNRA 2421/4885POLB 291/4885
US-20120135983-A1 DNA Damage Repair Inhibitors for the Treatment of Cancer MRE11, ERCC4, PARP2 EDNRB 2332/4885EDNRA 3306/4885POLB 46/4885
US-20210046072-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L PARP3, PARP11, GSK3A EDNRB 4462/4885EDNRA 4576/4885POLB 850/4885
US-10563197-B2 Use of a combination of Dbait molecule and PARP inhibitors to treat cancer PARP10, PARP1, PARP3 EDNRB 2661/4885EDNRA 2421/4885POLB 291/4885
US-20030176454-A1 N-coating heterocyclic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GNE, NIT2 EDNRB 1431/4885EDNRA 1781/4885POLB 2396/4885
US-10799501-B2 Combination of an inhibitor of PARP with an inhibitor of GSK-3 or DOT1L PARP3, PARP11, GSK3A EDNRB 4462/4885EDNRA 4576/4885POLB 850/4885
US-20180362972-A1 USE OF A COMBINATION OF DBAIT MOLECULE AND PARP INHIBITORS TO TREAT CANCER PARP10, PARP1, PARP3 EDNRB 2661/4885EDNRA 2421/4885POLB 291/4885
US-20190076427-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L PARP3, PARP11, GSK3A EDNRB 4462/4885EDNRA 4576/4885POLB 850/4885
US-20100249112-A1 COMBINATION OF CHK AND PARP INHIBITORS FOR THE TREATMENT OF CANCERS CHEK1, CHEK2, PARP1 EDNRB 4084/4885EDNRA 4296/4885POLB 611/4885

“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.