SCHEMBL5914285

SCHEMBL5914285

CN(c1ccnc(N[C@@H](CCO)c2ccccc2)n1)c1ccnc(-c2ccccc2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 15/20 0.43
▸ PRKACA P17612 2/20 0.40
▸ GSK3A P49840 2/20 0.40
▸ PRKX P51817 2/20 0.40
▸ ROCK1 Q13464 2/20 0.40
▸ CLK4 Q9HAZ1 2/20 0.40
▸ RPS6KB1 P23443 2/20 0.40
▸ PRKD3 O94806 1/20 0.40
▸ MAP4K4 O95819 1/20 0.40
▸ PRKCG P05129 1/20 0.40
▸ PIM1 P11309 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ AKT1 P31749 1/20 0.40
▸ AKT2 P31751 1/20 0.40
▸ FLT4 P35916 1/20 0.40
▸ CSNK1D P48730 1/20 0.40
▸ CLK2 P49760 1/20 0.40
▸ IRAK1 P51617 1/20 0.40
▸ RPS6KA3 P51812 1/20 0.40

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
SCHEMBL5914200 1.00 MAPK14 (0.43) MAPK14PRKACAGSK3APRKXROCK1
SCHEMBL5914195 1.00 MAPK14 (0.43) MAPK14PRKACAGSK3APRKXROCK1
SCHEMBL5914274 0.84 MAPK14 (0.37) MAPK14MAPK1
SCHEMBL5914396 0.79 KDM4E (0.42) MAPK14PRKACAGSK3APRKXROCK1
SCHEMBL5913813 0.79 CYP2D6 (0.43) MAPK14MAPK1GSK3B
SCHEMBL5265783 0.79 CYP2D6 (0.43) MAPK14MAPK1GSK3B
SCHEMBL5264548 0.78 MAPK14 (0.47) MAPK14
SCHEMBL5913860 0.77 NPR3 (0.47) MAPK14MAPK1EGFR
SCHEMBL5261647 0.77 NPR3 (0.47) MAPK14MAPK1EGFR
SCHEMBL5914027 0.76 MAPK14 (0.44) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060069110-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2006-03-30 — — US claimed
US-20060069110-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2006-03-30 — — 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 (1 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-20060069110-A1 Substituted heterocyclic compounds and methods of use MAPT, MYLK2, IAPP MAPK14 2620/4885PRKACA 3055/4885GSK3A 279/4885

“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.

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