SCHEMBL5114710

SCHEMBL5114710

Cc1cccc(-c2nc3cccnn3c2-c2ccnc(NCC3CC3)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 18/20 0.62
MAPK12 P53778 18/20 0.62
MAPK11 Q15759 18/20 0.62
MAPK14 Q16539 18/20 0.62
MAPK9 P45984 1/20 0.42
MAPK10 P53779 1/20 0.42
USP30 Q70CQ3 1/20 0.41

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
SCHEMBL5116064 0.95 MAPK14 (0.59) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5119941 0.87 MAPK14 (0.67) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5126280 0.87 MAPK14 (0.56) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5116347 0.85 MAPK14 (0.65) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5120005 0.85 MAPK14 (0.65) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5112021 0.85 MAPK13 (0.67) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5119972 0.85 MAPK14 (0.64) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5114881 0.84 MAPK14 (0.68) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5120125 0.84 MAPK14 (0.63) MAPK13MAPK12MAPK11MAPK14
SCHEMBL5116364 0.84 MAPK14 (0.63) MAPK13MAPK12MAPK11MAPK14

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 MAPK13 1/4885MAPK12 9/4885MAPK11 7/4885

“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.