SCHEMBL4175747

SCHEMBL4175747

COc1cccc(S(=O)(=O)NCC(=O)O)c1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 1/20 0.75
L3MBTL1 Q9Y468 1/20 0.67
ALDH1A1 P00352 2/20 0.61
LMNA P02545 2/20 0.61
POLB P06746 1/20 0.61
MAPT P10636 3/20 0.60
AKR1C3 P42330 2/20 0.57
GAA P10253 2/20 0.54
RECQL P46063 1/20 0.54
PGR P06401 1/20 0.53
APEX1 P27695 1/20 0.52
FFAR4 Q5NUL3 1/20 0.52
KMT2A Q03164 1/20 0.52
KEAP1 Q14145 1/20 0.52
NFE2L2 Q16236 1/20 0.52
MMP1 P03956 1/20 0.51
MMP12 P39900 1/20 0.51
KAT6A Q92794 1/20 0.51

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
SCHEMBL3199069 0.86 ATM (0.64) MEP1BL3MBTL1ALDH1A1LMNAPOLB
SCHEMBL2678034 0.83 ALDH1A1 (0.62) MEP1BL3MBTL1ALDH1A1LMNAPOLB
SCHEMBL8425825 0.82 MAPT (0.60) MEP1BALDH1A1POLBMAPTAPEX1
SCHEMBL4173740 0.81 MEP1B (0.67) MEP1BALDH1A1POLBMAPTGAA
SCHEMBL1822202 0.81 MEP1B (0.65) MEP1BL3MBTL1ALDH1A1LMNAPOLB
SCHEMBL3074642 0.81 ALDH1A1 (0.67) MEP1BL3MBTL1ALDH1A1AKR1C3
SCHEMBL23014100 0.81 HSD11B1 (0.66) MEP1BL3MBTL1ALDH1A1LMNAPOLB
SCHEMBL6774257 0.81 MEP1B (0.57) MEP1BL3MBTL1ALDH1A1LMNAPOLB
SCHEMBL30099024 0.81 MEP1B (0.64) MEP1BL3MBTL1ALDH1A1LMNAPOLB
SCHEMBL7668838 0.80 LMNA (0.68) L3MBTL1ALDH1A1LMNAPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215893-A1 Parakeratosis inhibitor, pore-shrinking agent,or rough skin preventing/ameliorating agent, and external composition for skin SHISEIDO COMPANY LTD (JP) 2009-08-27 US disclosed
EP-1884230-A1 PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT OR AGENT FOR PREVENTING/AMELIORATING ROUGH SKIN AND EXTERNAL COMPOSITION FOR SKIN Shiseido Company, Limited (JP) 2008-02-06 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-20090215893-A1 Parakeratosis inhibitor, pore-shrinking agent,or rough skin preventing/ameliorating agent, and external composition for skin CUTA, STOM, MTOR MEP1B 34/4885L3MBTL1 3111/4885ALDH1A1 3336/4885

“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.