SCHEMBL2408201

SCHEMBL2408201

CC(C)(Sc1nc(CCOc2ncc(-c3cccc(OCC(F)(F)F)c3)cn2)cs1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.40
SLC16A3 O15427 2/20 0.37
SLC16A1 P53985 2/20 0.37
MCTS1 Q9ULC4 1/20 0.37
PPARA Q07869 3/20 0.36
GAA P10253 2/20 0.35
ABL1 P00519 1/20 0.35
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
TP53 P04637 1/20 0.34
DGAT1 O75907 4/20 0.34
PPARG P37231 1/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
GGPS1 O95749 1/20 0.32
SLC22A12 Q96S37 1/20 0.32

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
SCHEMBL2415563 0.90 PPARA (0.42) CTSAPPARAGAAPPARG
SCHEMBL2414035 0.90 DGAT1 (0.39) PPARATP53DGAT1SLC22A12
SCHEMBL2415288 0.87 CTSA (0.39) CTSASLC16A3SLC16A1MCTS1PPARA
SCHEMBL2410912 0.85 PPARA (0.39) PPARAABL1TP53PPARGSLC22A12
SCHEMBL2411276 0.83 SLC22A12 (0.42) PPARATP53DGAT1PPARGSLC22A12
SCHEMBL2410667 0.83 MRGPRX4 (0.41) PPARAGAATP53HDAC1HDAC2
SCHEMBL2412787 0.82 SHMT2 (0.39) PPARAABL1DGAT1PPARGHDAC1
SCHEMBL2410198 0.81 PIM1 (0.42) CTSA
SCHEMBL2412565 0.81 SLC22A12 (0.42) PPARAPPARGSLC22A12
SCHEMBL2412207 0.80 SLC13A5 (0.42) CTSAPPARATP53PPARGHDAC1

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-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 CTSA 2272/4885SLC16A3 296/4885SLC16A1 259/4885

“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.