SCHEMBL129637

SCHEMBL129637

CNc1nc(N)nc2[nH]ncc12

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.58
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
HTR2C P28335 2/20 0.44
PTPN1 P18031 10/20 0.42
CDK2 P24941 1/20 0.41
CHUK O15111 1/20 0.41
RET P07949 1/20 0.40
PI4KA P42356 1/20 0.40
XDH P47989 1/20 0.40
LRRK2 Q5S007 1/20 0.40
PI4K2B Q8TCG2 1/20 0.40
PI4K2A Q9BTU6 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
ALDH1A1 P00352 1/20 0.39
PLK4 O00444 1/20 0.37
PAK4 O96013 1/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL31706902 1.00 PDPK1 (0.58) PDPK1ADORA2AADORA1HTR2CPTPN1
SCHEMBL14441306 0.79 PDPK1 (0.55) PDPK1HTR2CALDH1A1PLK4PAK4
SCHEMBL13828306 0.79 HTR2C (0.65) PDPK1HTR2CCDK2PLK4PAK4
SCHEMBL14561714 0.79 ADORA2A (0.43) PDPK1ADORA2AADORA1HTR2CCDK2
SCHEMBL130797 0.78 PDPK1 (0.53) PDPK1HTR2CALDH1A1PLK4PAK4
SCHEMBL130504 0.78 PLK4 (0.57) PDPK1HTR2CCDK2XDHALDH1A1
SCHEMBL130812 0.78 PDPK1 (0.53) PDPK1HTR2CALDH1A1PLK4PAK4
SCHEMBL28124221 0.77 ADORA2A (0.46) PDPK1ADORA2AADORA1HTR2CCDK2
SCHEMBL14570604 0.77 ADORA2A (0.47) PDPK1ADORA2AADORA1CDK2RET
SCHEMBL29487078 0.76 XDH (0.55) PDPK1ADORA2AADORA1CDK2RET

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
US-11858907-B2 Kinase modulators RHIZEN PHARMACEUTICALS AG (CH) 2024-01-02 US disclosed
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2018-04-26 US disclosed
US-9775841-B2 Compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2017-10-03 US disclosed
US-20160318890-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS AG (CH) 2016-11-03 US disclosed
US-9421209-B2 Kinase modulators RHIZEN PHARMACEUTICALS SA (CH) 2016-08-23 US disclosed
US-9421209-B2 Kinase modulators RHIZEN PHARMACEUTICALS SA (CH) 2016-08-23 US disclosed
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2015-11-12 US disclosed
US-20150174131-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS AG (CH) 2015-06-25 US disclosed
US-20150174131-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS AG (CH) 2015-06-25 US disclosed
US-9018375-B2 Substituted chromenes as kinase modulators RHIZEN PHARMACEUTICALS SA (CH) 2015-04-28 US disclosed
US-20140080827-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS SA (CH) 2014-03-20 US disclosed
US-8642607-B2 4H-chromen-4-one compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2014-02-04 US disclosed
US-8642607-B2 4H-chromen-4-one compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2014-02-04 US disclosed
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-11-15 US disclosed
US-20120059001-A1 NOVEL KINASE MODULATORS INCOZEN THERAPEUTICS PVT. LTD. (IN) 2012-03-08 US disclosed
US-20110118257-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS SA (CH) 2011-05-19 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 (9 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-20150174131-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PDPK1 30/4885ADORA2A 1556/4885ADORA1 3388/4885
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PDPK1 9/4885ADORA2A 1821/4885ADORA1 3736/4885
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PDPK1 9/4885ADORA2A 1821/4885ADORA1 3736/4885
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PDPK1 9/4885ADORA2A 1821/4885ADORA1 3736/4885
US-20140080827-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PDPK1 30/4885ADORA2A 1556/4885ADORA1 3388/4885
US-20110118257-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PDPK1 30/4885ADORA2A 1556/4885ADORA1 3388/4885
US-11858907-B2 Kinase modulators RPS6KA1, RPS6KA2, PRKAR2A PDPK1 65/4885ADORA2A 1129/4885ADORA1 1608/4885
US-20160318890-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PDPK1 30/4885ADORA2A 1556/4885ADORA1 3388/4885
US-20120059001-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PDPK1 30/4885ADORA2A 1556/4885ADORA1 3388/4885

“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.