SCHEMBL5447232

SCHEMBL5447232

COC(=O)c1ccccc1CSc1ccc(CN(O)C(=O)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.45
PPARA Q07869 6/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
SLC6A3 Q01959 1/20 0.40
CXCR2 P25025 1/20 0.40
PKM P14618 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL5448702 0.87 PPARG (0.48) PPARGPPARAALDH1A1LMNA
SCHEMBL5447478 0.85 PTGDR2 (0.44) PTGDR2L3MBTL1SLC6A3CXCR2PKM
SCHEMBL31123647 0.80 L3MBTL1 (0.58) PPARGPPARAPTGDR2L3MBTL1CXCR2
SCHEMBL11274332 0.80 L3MBTL1 (0.58) PPARGPPARAPTGDR2L3MBTL1CXCR2
SCHEMBL4630498 0.80 PPARG (0.55) PPARGPPARAPTGDR2L3MBTL1PKM
SCHEMBL5438157 0.80 PPARG (0.49) PPARGPPARAPTGDR2L3MBTL1CXCR2
SCHEMBL4631073 0.78 PPARG (0.51) PPARGPPARAPTGDR2L3MBTL1PKM
SCHEMBL5440957 0.77 PPARG (0.38) PPARGPPARAPTGDR2L3MBTL1ALDH1A1
SCHEMBL25685760 0.76 CXCR2 (0.57) PPARGPPARAPTGDR2L3MBTL1SLC6A3
SCHEMBL27547400 0.73 ALDH1A1 (0.50) PPARGPPARAPTGDR2L3MBTL1CXCR2

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-20070015799-A1 Glyoxalase inhibitors CHROMA THERAPEUTICS LIMITED (GB) 2007-01-18 US disclosed
US-20070015799-A1 Glyoxalase inhibitors CHROMA THERAPEUTICS LIMITED (GB) 2007-01-18 US disclosed
US-20070015799-A1 Glyoxalase inhibitors CHROMA THERAPEUTICS LIMITED (GB) 2007-01-18 US disclosed
EP-1622869-A1 GLYOXALASE INHIBITORS Chroma Therapeutics Limited (GB) 2006-02-08 EP disclosed
WO-2004101506-A1 GLYOXALASE INHIBITORS CHROMA THERAPEUTICS LIMITED (GB) 2004-11-25 WO 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-20070015799-A1 Glyoxalase inhibitors GLO1, LOX, LOXL1 PPARG 4267/4885PPARA 4574/4885PTGDR2 3212/4885

“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.