SCHEMBL1554515

SCHEMBL1554515

CC(C)Nc1nccc(-c2c[nH]nc2-c2ccc(F)cc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 3/20 0.52
MAPK9 P45984 2/20 0.47
MAPK10 P53779 2/20 0.47
MAPK13 O15264 6/20 0.46
PRKD3 O94806 1/20 0.46
MAP4K4 O95819 1/20 0.46
LCK P06239 1/20 0.46
LYN P07948 1/20 0.46
MAPK1 P28482 1/20 0.46
AKT2 P31751 1/20 0.46
FLT4 P35916 1/20 0.46
FLT3 P36888 1/20 0.46
FRK P42685 1/20 0.46
CSNK1A1 P48729 1/20 0.46
CSNK1D P48730 1/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46
CSNK1G2 P78368 1/20 0.46
MAP4K2 Q12851 1/20 0.46
DYRK1A Q13627 1/20 0.46

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
SCHEMBL5260080 0.86 MAPK14 (0.49) MAPK9MAPK13GSK3BDYRK1AMAPK14
SCHEMBL5308445 0.81 AURKA (0.39) MAPK9PRKD3MAP4K4FLT4FRK
SCHEMBL5464101 0.81 MAPK14 (0.47) MAPK13GSK3BMAPK14MAPK12MAPK11
SCHEMBL5457939 0.81 KCNH3 (0.49) MAPK8MAPK9MAPK13PRKD3MAP4K4
SCHEMBL5308448 0.81 MKNK1 (0.43) MAPK8MAPK9MAPK13PRKD3MAP4K4
SCHEMBL5255249 0.80 CDK4 (0.54) MAPK8MAPK9MAPK10MAPK13PRKD3
SCHEMBL5256677 0.80 MAPK14 (0.52) MAPK9MAPK13MAPK14MAPK12MAPK11
SCHEMBL5256181 0.80 MAPK14 (0.41) MAPK13GSK3AGSK3BMAPK14MAPK12
SCHEMBL2049300 0.80 MAPK8 (0.46) MAPK8MAPK9MAPK10MAPK13MAPK14
SCHEMBL5256587 0.79 CCNB2 (0.56) MAPK8FLT3GSK3BMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2784073-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
EP-2784072-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
EP-2784070-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
EP-2784071-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
US-20130281455-A1 Phenylpyri(mi)dinylazoles BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-10-24 US disclosed
CN-102834387-A Phenylpyri(mi)dinylpyrazoles and their use as fungicides BAYER CROPSCIENCE AG 2012-12-19 CN disclosed
EP-2486031-A2 Phenylpyri(mi)dinylpyrazoles and their use as fungicides Bayer CropScience AG (DE) 2012-08-15 EP disclosed
US-20110183978-A1 Phenylpyri(mi)dinylazoles BAYER CROPSCIENCE AG (DE) 2011-07-28 US disclosed
WO-2011042389-A2 PHENYLPYRI(MI)DINYLAZOLES BAYER CROPSCIENCE AG (DE) 2011-04-14 WO 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 (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-20130281455-A1 Phenylpyri(mi)dinylazoles PIR, PIN4, PNN MAPK8 1656/4885MAPK9 1051/4885MAPK10 3137/4885
US-20110183978-A1 Phenylpyri(mi)dinylazoles PIR, PIN4, PNN MAPK8 1656/4885MAPK9 1051/4885MAPK10 3137/4885

“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.