SCHEMBL2414890

SCHEMBL2414890

CCc1cnc(N(CCCOCc2ccccc2)CCc2csc(SC(C)(C)C(=O)O)n2)nc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.37
DDR2 Q16832 5/20 0.35
FGFR1 P11362 6/20 0.35
KDR P35968 6/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
PPARA Q07869 1/20 0.34
MAPK13 O15264 1/20 0.30
MAPK12 P53778 1/20 0.30
DDR1 Q08345 1/20 0.30
MAPK11 Q15759 1/20 0.30
PPARD Q03181 1/20 0.30

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
SCHEMBL2418172 0.96 MAPK14 (0.39) MAPK14DDR2FGFR1KDRL3MBTL1
SCHEMBL2415449 0.91 PPARA (0.37) PPARAPPARD
SCHEMBL2413325 0.90 PPARA (0.34) PPARA
SCHEMBL2416596 0.90 PPARA (0.36) PPARA
SCHEMBL12275082 0.90 PPARA (0.35) PPARAPPARD
Bromide SCHEMBL2409569 0.89 PPARA (0.34) PPARAPPARD
SCHEMBL2414012 0.88 PPARA (0.38) PPARAPPARD
Bromide SCHEMBL2409567 0.88 PPARA (0.34) PPARAPPARD
SCHEMBL2408014 0.86 PPARA (0.36) MAPK14DDR2PPARA
SCHEMBL2409301 0.86 PPARA (0.39) PPARAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8026370-B2 Peroxisome proliferator antagonist; hyperlipemia agents; arteriosclerosis; antiischemic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-27 US claimed
US-8026370-B2 Peroxisome proliferator antagonist; hyperlipemia agents; arteriosclerosis; antiischemic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-27 US disclosed
US-8026370-B2 Peroxisome proliferator antagonist; hyperlipemia agents; arteriosclerosis; antiischemic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-27 US disclosed
US-8026370-B2 Peroxisome proliferator antagonist; hyperlipemia agents; arteriosclerosis; antiischemic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-27 US disclosed
US-20080167307-A1 Carboxylic Acid Derivative Containing Thiazole Ring and Pharmaceutical Use Thereof MITSUBISHI PHAMA CORPORATION (JP) 2008-07-10 US disclosed
US-20080167307-A1 Carboxylic Acid Derivative Containing Thiazole Ring and Pharmaceutical Use Thereof MITSUBISHI PHAMA CORPORATION (JP) 2008-07-10 US disclosed
EP-1816128-A1 CARBOXYLIC ACID DERIVATIVE CONTAINING THIAZOLE RING AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2007-08-08 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-20080167307-A1 Carboxylic Acid Derivative Containing Thiazole Ring and Pharmaceutical Use Thereof PPARA, PPARD, PPARG MAPK14 2153/4885DDR2 3095/4885FGFR1 94/4885

“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.