SCHEMBL4408977

SCHEMBL4408977

CC(=O)c1nc2nc(-c3ccc(F)cc3)c(-c3ccncc3)c(-c3ccc(F)cc3)c2n1C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.45
MAPK11 Q15759 4/20 0.43
MAPK13 O15264 3/20 0.43
MAPK12 P53778 3/20 0.43
KCNH2 Q12809 1/20 0.41
CSNK1D P48730 3/20 0.41
CSNK1E P49674 3/20 0.41
CSNK1A1 P48729 1/20 0.41
ALOX5 P09917 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SRC P12931 1/20 0.40
BRAF P15056 1/20 0.40
KDR P35968 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
SCHEMBL4410497 0.91 MAPK14 (0.44) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL4410550 0.85 ALOX5 (0.49) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL4411060 0.82 MAPK14 (0.44) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL4408770 0.80 MAPK14 (0.46) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL4415373 0.79 MAPK14 (0.44) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL4410172 0.78 MAPK14 (0.47) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL4408284 0.74 MAPK14 (0.58) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL4408115 0.73 MAPK14 (0.47) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL4410204 0.72 MAPK14 (0.46) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL4409114 0.70 HTR3A (0.47) MAPK14MAPK11MAPK13MAPK12ALOX5

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-20090264446-A9 Condensed Pyridines as Kinase Inhibitors PALAU PHARMA, S.A. (ES) 2009-10-22 US claimed
US-20080318977-A1 Condensed Pyridines as Kinase Inhibitors PALAU PHARMA, S.A. (ES) 2008-12-25 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20090264446-A9 Condensed Pyridines as Kinase Inhibitors MAPK1, MAP4K2, MAP3K1 MAPK14 36/4885MAPK11 42/4885MAPK13 39/4885
US-20080318977-A1 Condensed Pyridines as Kinase Inhibitors MAPK1, MAP4K2, MAP3K1 MAPK14 36/4885MAPK11 42/4885MAPK13 39/4885

“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.