SCHEMBL2409648

SCHEMBL2409648

CCc1ccc(NCCc2csc(SC(C)(C)C(=O)OC(C)(C)C)n2)nc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.33
LMNA P02545 1/20 0.33
PTPRB P23467 1/20 0.33
MAPT P10636 2/20 0.32
HCAR3 P49019 4/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31
HDAC1 Q13547 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
SCHEMBL2409126 0.89 RAB9A (0.36) LMNAMAPTSMN1; SMN2GAAHTT
SCHEMBL2412613 0.88 MAPT (0.35) LMNAMAPTSMN1; SMN2GAA
SCHEMBL2414015 0.87 PTPRB (0.31) TP53LMNAPTPRBGAAHTT
SCHEMBL12274082 0.84 TP53 (0.40) TP53LMNAMAPTSMN1; SMN2
SCHEMBL2409378 0.84 CYP1A2 (0.44) TP53LMNAMAPTSMN1; SMN2GAA
SCHEMBL2412646 0.83
SCHEMBL2417076 0.82 LMNA (0.34) TP53LMNAPTPRBMAPTSMN1; SMN2
SCHEMBL2416608 0.80 ACACB (0.34)
SCHEMBL2408623 0.79 TP53 (0.39) TP53LMNAMAPTSMN1; SMN2
SCHEMBL2411576 0.79 CYP1A2 (0.43) TP53LMNAMAPTSMN1; SMN2HDAC1

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 3 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-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 TP53 2553/4885LMNA 3376/4885PTPRB 1859/4885

“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.