SCHEMBL5118701

SCHEMBL5118701

CCC(=O)Nc1cc(-c2c(-c3ccc(F)c(C)c3)nc3cccnn23)ccn1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.77
MAPK13 O15264 17/20 0.77
MAPK12 P53778 17/20 0.77
MAPK11 Q15759 17/20 0.77
GSK3B P49841 1/20 0.47

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
SCHEMBL5126609 0.93 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5125621 0.91 MAPK14 (0.85) MAPK14MAPK13MAPK12MAPK11GSK3B
SCHEMBL14131941 0.91 MAPK14 (0.73) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5125460 0.91 MAPK14 (0.73) MAPK14MAPK13MAPK12MAPK11GSK3B
SCHEMBL5118552 0.91 MAPK14 (0.73) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5113632 0.90 MAPK14 (0.72) MAPK14MAPK13MAPK12MAPK11GSK3B
SCHEMBL5127417 0.90 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11GSK3B
SCHEMBL5121424 0.89 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5115606 0.89 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11
Trifluoroacetic Acid SCHEMBL5116856 0.89 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080167314-A1 Condensed Imidazole Compound And Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-10 US disclosed
US-20080167314-A1 Condensed Imidazole Compound And Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-10 US disclosed
US-20080167314-A1 Condensed Imidazole Compound And Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-10 US disclosed
EP-1832588-A1 CONDENSED IMIDAZOLE COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-09-12 EP disclosed
EP-1832588-A1 CONDENSED IMIDAZOLE COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-09-12 EP 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-20080167314-A1 Condensed Imidazole Compound And Use Thereof MAPK13, MMP13, MAPK3 MAPK14 5/4885MAPK13 1/4885MAPK12 9/4885

“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.