SCHEMBL794250

SCHEMBL794250

O=C1NCC=Nc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP11 Q9NR21 7/20 0.44
PARP10 Q53GL7 6/20 0.44
PARP1 P09874 5/20 0.44
PDPK1 O15530 1/20 0.44
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
GSK3B P49841 1/20 0.37
PIM1 P11309 2/20 0.34
CSNK1A1 P48729 2/20 0.34
DYRK1A Q13627 2/20 0.34
CLK4 Q9HAZ1 2/20 0.34
CDK5 Q00535 1/20 0.34
ROCK1 Q13464 1/20 0.34
LRRK2 Q5S007 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
MAPKAPK2 P49137 4/20 0.33
CDK1 P06493 2/20 0.33
MAPKAPK3 Q16644 2/20 0.33
MAPKAPK5 Q8IW41 2/20 0.33
PLK4 O00444 1/20 0.33

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
SCHEMBL16057480 0.87 PARP11 (0.42) PARP11PARP10PARP1PDPK1CA12
SCHEMBL26512083 0.74 TDP2 (0.38) PARP11PARP10PARP1PDPK1CA12
SCHEMBL26345734 0.73 PARP1 (0.38) PARP11PARP10PARP1PDPK1CA12
SCHEMBL699630 0.73 NPC1 (0.40) PARP11PARP10PARP1CA12CA9
SCHEMBL11011352 0.72 CA12 (0.45) PARP11PARP10PARP1PDPK1CA12
SCHEMBL123760 0.71 ALDH1A1 (0.32) MEN1MAPTKMT2A
SCHEMBL29419088 0.71 ALDH1A1 (0.32) MEN1MAPTKMT2A
SCHEMBL21298564 0.71 PARP1 (0.43) PARP1MAPK1MEN1GAAMAPT
SCHEMBL30124040 0.71 NOS2 (0.40) PARP11PARP10PARP1PDPK1CA12
SCHEMBL31116 0.69 MEN1 (0.35) GSK3BMAPK1MEN1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3761978-A1 INHIBITORS OF PROTEIN ARGININE METHYLTRANSFERASE 5 (PRMT5), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF PHARMABLOCK SCIENCES (NANJING), INC. (CN) 2021-01-13 EP claimed
WO-2019173804-A1 INHIBITORS OF PROTEIN ARGININE METHYLTRANSFERASE 5 (PRMT5), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF PHARMABLOCK SCIENCES (NANJING), INC. (CN) 2019-09-12 WO claimed
EP-1540329-A4 DRUG DISCOVERY METHOD KEDDEM BIO SCIENCE LTD (IL) 2009-06-10 EP claimed
JP-2006507480-A 2006-03-02 JP claimed
EP-1540329-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2005-06-15 EP claimed
WO-2004010136-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2004-01-29 WO claimed
US-20240226320-A1 DRUG CONJUGATES WITH SELF-STABILIZING LINKERS HAVING IMPROVED PHYSIOCHEMICAL PROPERTIES SEAGEN INC (US) 2024-07-11 US disclosed
US-20240226320-A1 DRUG CONJUGATES WITH SELF-STABILIZING LINKERS HAVING IMPROVED PHYSIOCHEMICAL PROPERTIES SEAGEN INC (US) 2024-07-11 US disclosed
EP-3441072-B1 ACTIVATED CARBON FILTRATION FOR PURIFICATION OF BENZODIAZEPINE ADCS SEAGEN INC (US) 2020-12-30 EP disclosed
US-20190167806-A1 DRUG CONJUGATES WITH SELF-STABILIZING LINKERS HAVING IMPROVED PHYSIOCHEMICAL PROPERTIES SEATTLE GENETICS, INC. (US) 2019-06-06 US disclosed
EP-3441072-A1 ACTIVATED CARBON FILTRATION FOR PURIFICATION OF BENZODIAZEPINE ADCS Seattle Genetics, Inc. (US) 2019-02-13 EP disclosed
EP-3441072-A1 ACTIVATED CARBON FILTRATION FOR PURIFICATION OF BENZODIAZEPINE ADCS Seattle Genetics, Inc. (US) 2019-02-13 EP disclosed
US-9987374-B2 Cyclodextrin and antibody-drug conjugate formulations SEATTLE GENETICS, INC. (US) 2018-06-05 US disclosed
US-8019550-B2 Drug discovery method Keddem Bioscience Ltd. (IL) 2011-09-13 US disclosed
US-8019550-B2 Drug discovery method Keddem Bioscience Ltd. (IL) 2011-09-13 US disclosed
US-8019550-B2 Drug discovery method Keddem Bioscience Ltd. (IL) 2011-09-13 US disclosed
EP-1540329-A4 DRUG DISCOVERY METHOD KEDDEM BIO SCIENCE LTD (IL) 2009-06-10 EP disclosed
US-20050277117-A1 Drug discovery method KEDDEM BIO-SCIENCE LTD. (IL) 2005-12-15 US disclosed
EP-1540329-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2005-06-15 EP disclosed
WO-2004010136-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2004-01-29 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 (2 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-20190167806-A1 DRUG CONJUGATES WITH SELF-STABILIZING LINKERS HAVING IMPROVED PHYSIOCHEMICAL PROPERTIES CD44, CD47, UACA PARP11 1717/4885PARP10 1254/4885PARP1 1148/4885
US-20240226320-A1 DRUG CONJUGATES WITH SELF-STABILIZING LINKERS HAVING IMPROVED PHYSIOCHEMICAL PROPERTIES CD44, CD47, UACA PARP11 1717/4885PARP10 1254/4885PARP1 1148/4885

“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.