SCHEMBL13828343

SCHEMBL13828343

CNc1nc(N)nc(N)c1C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.38
HSP90AB1 P08238 1/20 0.34
PTPN1 P18031 1/20 0.34
PIK3CD O00329 1/20 0.33
CHUK O15111 1/20 0.32
GFER P55789 1/20 0.31
POLB P06746 2/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNA1 P78396 1/20 0.31
ADORA3 P0DMS8 1/20 0.30
ADORA2B P29275 1/20 0.30
ADORA1 P30542 1/20 0.30
NNMT P40261 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
SCHEMBL13828345 0.83 GFER (0.30) GFERPOLB
SCHEMBL13828336 0.83 GFER (0.33) GFERPOLBCCNA2CDK2
SCHEMBL13828406 0.83 POLB (0.33) GFERPOLBNNMT
SCHEMBL13828346 0.81 LMNA (0.37) POLBNNMT
SCHEMBL15868896 0.79 MEN1 (0.33)
SCHEMBL15868912 0.79 KDM4E (0.38) PDPK1HSP90AB1GFER
SCHEMBL13766483 0.79 PDPK1 (0.50) PDPK1HSP90AB1POLBCCNA2CDK2
SCHEMBL18704234 0.75 PDPK1 (0.43) PDPK1HSP90AB1POLBCCNA2CDK2
SCHEMBL13828430 0.72 HSPA8 (0.38) PDPK1PIK3CDNNMT
SCHEMBL15817068 0.71 POLB (0.47) PDPK1HSP90AB1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-9775841-B2 Compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2017-10-03 US disclosed
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2015-11-12 US disclosed
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-11-15 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 (3 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-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PDPK1 9/4885HSP90AB1 509/4885PTPN1 762/4885
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PDPK1 9/4885HSP90AB1 509/4885PTPN1 762/4885
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PDPK1 9/4885HSP90AB1 509/4885PTPN1 762/4885

“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.