SCHEMBL12838026

SCHEMBL12838026

CCc1cnc2c(c1)/C(=C\c1cnc[nH]1)C(=O)N2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLK2 Q86UE8 11/20 0.51
▸ CDK5 Q00535 3/20 0.50
▸ MAPT P10636 2/20 0.50
▸ CDK5R1 Q15078 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ PTK2B Q14289 1/20 0.50
▸ CDK1 P06493 2/20 0.49
▸ RET P07949 2/20 0.49
▸ CDK2 P24941 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ KDR P35968 2/20 0.49
▸ GSK3A P49840 2/20 0.49
▸ GSK3B P49841 2/20 0.49
▸ CDK7 P50613 2/20 0.49
▸ CDK9 P50750 2/20 0.49
▸ PDPK1 O15530 2/20 0.49
▸ NTRK1 P04629 2/20 0.49
▸ JAK3 P52333 2/20 0.49
▸ MELK Q14680 2/20 0.49
▸ PLK4 O00444 1/20 0.49

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
SCHEMBL12064437 0.81 TLK2 (0.67) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL21237108 0.81 TLK2 (0.67) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL12727794 0.81 TLK2 (0.67) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL12765395 0.81 CSF1R (0.53) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL11926760 0.78 TLK2 (0.63) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL6394041 0.74 TLK2 (0.65) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL6394046 0.74 TLK2 (0.65) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL8351341 0.74 RAF1 (0.55) MAPTCDK2MAPK1NTRK1PLK4
SCHEMBL8351339 0.74 RAF1 (0.55) MAPTCDK2MAPK1NTRK1PLK4
SCHEMBL20401696 0.71 TLK2 (0.67) TLK2CDK5MAPTCDK5R1SMN1; SMN2

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-7897619-B2 Heterocyclic modulators of PKB AMGEN INC. (US) 2011-03-01 — — US disclosed
US-20090275592-A1 Heterocyclic modulators of PKB AMGEN INC. (US) 2009-11-05 — — 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-20090275592-A1 Heterocyclic modulators of PKB MTOR, PDK1, EIF4EBP1 TLK2 1062/4885CDK5 162/4885MAPT 4193/4885

“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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