SCHEMBL12413596

SCHEMBL12413596

CNC(=O)c1ccccc1Nc1cc(NC)ncc1C#N

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 7/20 0.58
PTK2 Q05397 1/20 0.55
TYK2 P29597 9/20 0.52
JAK1 P23458 8/20 0.52
JAK2 O60674 7/20 0.52
MAPK9 P45984 5/20 0.48
MAPK3 P27361 1/20 0.48
MAPK1 P28482 1/20 0.48
PDE4D Q08499 3/20 0.48
KIT P10721 1/20 0.43
KCNH2 Q12809 1/20 0.43
MAPK8 P45983 1/20 0.43
IRAK4 Q9NWZ3 1/20 0.43

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
SCHEMBL1231895 0.86 PTK2 (0.52) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL1232852 0.86 PTK2 (0.52) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL12900861 0.86 PTK2 (0.52) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL690995 0.83 MAPK3 (0.56) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL1560826 0.83 MAPK10 (0.56) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL12413615 0.81 MAPK3 (0.68) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL12413721 0.81 TYK2 (0.56) MAPK10TYK2JAK1JAK2MAPK9
SCHEMBL1558483 0.80 MAPK10 (0.58) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL12102951 0.79 MAPK10 (0.74) MAPK10PTK2TYK2JAK1JAK2
SCHEMBL2063944 0.75 ULK1 (0.55) MAPK10PTK2MAPK9MAPK8

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-8569298-B2 Pyridine compounds ASTRAZENECA AB (SE) 2013-10-29 US disclosed
US-20110166139-A1 PYRIDINE COMPOUNDS ASTRAZENECA AB (SE) 2011-07-07 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-20110166139-A1 PYRIDINE COMPOUNDS PTK2, PTK2B, PFKP MAPK10 301/4885PTK2 1/4885TYK2 351/4885

“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.