SCHEMBL1640844

SCHEMBL1640844

CC(=O)c1c(-c2ccc(F)cc2)ncn1C1CCN(C(=O)O)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.44
TGFBR1 P36897 7/20 0.41
MAPK11 Q15759 2/20 0.41
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
CSNK1D P48730 3/20 0.40
CSNK1E P49674 3/20 0.40
TGFBR2 P37173 1/20 0.38
CYP46A1 Q9Y6A2 2/20 0.37
EGFR P00533 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL1640914 0.91 TGFBR1 (0.46) MAPK14TGFBR1MAPK11MAPK13MAPK12
SCHEMBL12727176 0.86 TGFBR1 (0.51) MAPK14TGFBR1EGFR
SCHEMBL1905858 0.82 USP2 (0.39) MAPK14EGFR
SCHEMBL6953086 0.82 MAPK14 (0.64) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL7942534 0.82 MAPK14 (0.50) MAPK14TGFBR1
SCHEMBL1640318 0.79 TGFBR1 (0.58) MAPK14TGFBR1MAPK11MAPK13MAPK12
SCHEMBL7950070 0.79 MAPK14 (0.58) MAPK14CSNK1DCSNK1EEGFR
SCHEMBL1639982 0.77 MAPK14 (0.52) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL1640716 0.76 MAPK14 (0.72) MAPK14MAPK11MAPK13MAPK12CSNK1D
SCHEMBL7950076 0.75 MAPK14 (0.56) MAPK14TGFBR1MAPK11MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2493876-B1 IMIDAZOLE DERIVATIVES AS CASEIN KINASE INHIBITORS PFIZER (US) 2014-02-12 EP disclosed
US-8518944-B2 Compounds as casein kinase inhibitors PFIZER INC. (US) 2013-08-27 US disclosed
US-20110098272-A1 Novel Compounds As Casein Kinase Inhibitors PFIZER INC 2011-04-28 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-20110098272-A1 Novel Compounds As Casein Kinase Inhibitors CSNK1A1, CSNK1A1L, CSNK1G1 MAPK14 169/4885TGFBR1 3920/4885MAPK11 295/4885

“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.