SCHEMBL5114556

SCHEMBL5114556

Cc1cccc(-c2nc3cccnn3c2-c2ccnc(NCc3ccco3)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.60
MAPK13 O15264 16/20 0.60
MAPK12 P53778 16/20 0.60
MAPK11 Q15759 16/20 0.60
PKM P14618 1/20 0.46
PKLR P30613 1/20 0.46
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL5114881 0.86 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5119941 0.86 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5126840 0.85 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5116347 0.84 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5112021 0.83 MAPK13 (0.67) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5119972 0.83 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5120125 0.82 MAPK14 (0.63) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5114710 0.81 MAPK13 (0.62) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5127773 0.81 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5125478 0.80 MAPK14 (0.60) 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.