SCHEMBL5438152

SCHEMBL5438152

COC(=O)c1ccccc1CSc1cccc(CO)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.53
PPARA Q07869 9/20 0.53
L3MBTL1 Q9Y468 3/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
CXCR2 P25025 1/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL5438157 0.85 PPARG (0.49) PPARGPPARAL3MBTL1ALDH1A1LMNA
SCHEMBL31123647 0.83 L3MBTL1 (0.58) PPARGPPARAL3MBTL1ALDH1A1LMNA
SCHEMBL11274332 0.83 L3MBTL1 (0.58) PPARGPPARAL3MBTL1ALDH1A1LMNA
SCHEMBL5565855 0.80 PPARG (0.51) PPARGPPARAL3MBTL1ALDH1A1KDM4E
SCHEMBL8891102 0.76 MAPT (0.48) L3MBTL1ALDH1A1LMNAKDM4EPOLB
SCHEMBL15143214 0.76 HSD17B10 (0.67) L3MBTL1ALDH1A1LMNAPKMPTGDR2
SCHEMBL25685760 0.76 CXCR2 (0.57) PPARGPPARAL3MBTL1ALDH1A1LMNA
SCHEMBL4630498 0.75 PPARG (0.55) PPARGPPARAL3MBTL1ALDH1A1LMNA
SCHEMBL28104330 0.75 L3MBTL1 (0.51) PPARGPPARAL3MBTL1ALDH1A1LMNA
SCHEMBL22071077 0.74 SLC6A3 (0.58) ALDH1A1KDM4EGLAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070015799-A1 Glyoxalase inhibitors CHROMA THERAPEUTICS LIMITED (GB) 2007-01-18 US 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 4574/4885L3MBTL1 114/4885

“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.