SCHEMBL20093433

SCHEMBL20093433

Nc1nc(NI)c2nc[nH]c2n1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.37
PDPK1 O15530 1/20 0.35
GDA Q9Y2T3 1/20 0.35
CHUK O15111 1/20 0.34
CDK1 P06493 1/20 0.34
BRAF P15056 9/20 0.33
DPP4 P27487 1/20 0.33
PRKACA P17612 3/20 0.33
NUDT1 P36639 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAP3K5 Q99683 1/20 0.31

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
SCHEMBL129817 0.85 CHUK (0.44) CDK2PDPK1GDACHUKCDK1
SCHEMBL8485064 0.83 PDPK1 (0.36) CDK2PDPK1GDACHUKCDK1
SCHEMBL2938904 0.81 BRAF (0.36) CDK2PDPK1GDACHUKCDK1
SCHEMBL887882 0.77 BRAF (0.39) CDK2PDPK1GDACHUKCDK1
SCHEMBL8348019 0.77 NLRP3 (0.40) CDK2CHUKCDK1BRAFPRKACA
SCHEMBL9168808 0.77 APP (0.44) CDK2PDPK1GDACHUKCDK1
Guanine SCHEMBL2216795 0.77 BRAF (0.38) CDK2PDPK1GDACDK1BRAF
SCHEMBL135689 0.77 CDK2 (0.52) CDK2PDPK1GDACDK1DPP4
Guanine SCHEMBL31714144 0.77 BRAF (0.38) CDK2PDPK1GDACDK1BRAF
2,6-Diaminopurine SCHEMBL24052 0.76 GDA (0.48) CDK2PDPK1GDACDK1DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10322130-B2 Substituted chromenones as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2019-06-18 US disclosed
US-20190105324-A9 SUBSTITUTED CHROMENONES AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2019-04-11 US disclosed
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2018-04-26 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-20190105324-A9 SUBSTITUTED CHROMENONES AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKAR2B CDK2 210/4885PDPK1 19/4885GDA 2485/4885
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB CDK2 212/4885PDPK1 9/4885GDA 2744/4885
US-10322130-B2 Substituted chromenones as modulators of protein kinases MAP3K1, CSNK1A1, MAP3K2 CDK2 48/4885PDPK1 50/4885GDA 4179/4885

“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.