SCHEMBL7078459

SCHEMBL7078459

COCC[N]S(=O)(=O)c1ccc(-c2ccc(OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 3/20 0.48
F2 P00734 2/20 0.47
PRSS1 P07477 2/20 0.47
PRSS2 P07478 2/20 0.47
PRSS3 P35030 2/20 0.47
PKM P14618 3/20 0.46
USP2 O75604 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MMP2 P08253 4/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL8789501 0.80 F2 (0.53) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL8340323 0.79 ALDH1A1 (0.54) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL6100059 0.79 F2 (0.56) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL7076663 0.76 F2 (0.56) ALDH1A1KDM4EF2PRSS1PRSS2
SCHEMBL7310589 0.76 F2 (0.56) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL8789462 0.76 F2 (0.49) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL8374521 0.72 F2 (0.51) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL6920362 0.72 PKM (0.64) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL12883762 0.71 PKM (0.57) ALDH1A1KDM4EPKMUSP2HSD17B10
SCHEMBL7301521 0.70 PKM (0.61) ALDH1A1F2PRSS1PRSS2PRSS3

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-20030144292-A1 Carbocyclic side chain containing, N-substituted metalloprotease inhibitors PROCTER & GAMBLE COMPANY, THE 2003-07-31 US claimed
US-20030144292-A1 Carbocyclic side chain containing, N-substituted metalloprotease inhibitors PROCTER & GAMBLE COMPANY, THE 2003-07-31 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-20030144292-A1 Carbocyclic side chain containing, N-substituted metalloprotease inhibitors MMP2, MMP3, CMA1 ALDH1A1 494/4885KDM4E 3391/4885F2 780/4885

“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.