SCHEMBL2409355

SCHEMBL2409355

CC(C)(Sc1nc(CCOc2ccc(-c3ccc(C(F)(F)F)cc3)nn2)cs1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.40
PPARA Q07869 1/20 0.40
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LTB4R Q15722 3/20 0.36
TP53 P04637 7/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 3/20 0.35
PPARD Q03181 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL2412721 0.92 RAB9A (0.42) SLC22A12PPARAALDH1A1L3MBTL1LTB4R
SCHEMBL2412316 0.90 SHMT2 (0.37) SLC22A12PPARAALDH1A1PPARDSMN1; SMN2
SCHEMBL2416099 0.89 PPARA (0.40) SLC22A12PPARAALDH1A1L3MBTL1LTB4R
SCHEMBL2415183 0.88 PPARA (0.41) SLC22A12PPARALTB4R
SCHEMBL2414426 0.87 SLC22A12 (0.41) SLC22A12PPARAALDH1A1L3MBTL1LTB4R
Hydrochloric Acid SCHEMBL2411986 0.86 DGAT1 (0.41) SLC22A12PPARALTB4RTP53LMNA
SCHEMBL2410471 0.86 SLC22A12 (0.41) SLC22A12PPARAPPARDNPC1RAB9A
SCHEMBL2413963 0.85 PPARA (0.45) SLC22A12PPARATP53LMNAPPARD
SCHEMBL2410859 0.85 PPARA (0.39) SLC22A12PPARALTB4R
SCHEMBL2418574 0.84 ABL1 (0.38) SLC22A12PPARAALDH1A1TP53MAPT

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 6 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-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 SLC22A12 920/4885PPARA 1/4885ALDH1A1 175/4885

“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.