SCHEMBL15216748

SCHEMBL15216748

Cc1cc(F)cc(C)c1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
FABP4 P15090 2/20 0.38
FABP3 P05413 1/20 0.38
FABP5 Q01469 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
FFAR4 Q5NUL3 2/20 0.36
F2 P00734 2/20 0.35
PRSS1 P07477 2/20 0.35
PRSS2 P07478 2/20 0.35
PRSS3 P35030 2/20 0.35
NR3C1 P04150 1/20 0.35
PGR P06401 1/20 0.35
NR3C2 P08235 1/20 0.35

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
Ammonia Solution, Strong SCHEMBL5999943 0.80 CA1 (0.58) CA1CA2MMP1MMP2MMP9
SCHEMBL23788 0.80 CA1 (0.58) CA1CA2MMP1MMP2MMP9
SCHEMBL7930818 0.80 CA1 (0.58) CA1CA2MMP1MMP2MMP9
SCHEMBL10846507 0.80 CA1 (0.58) CA1CA2MMP1MMP2MMP9
SCHEMBL28656334 0.78 CA1 (0.56) CA1CA2MMP1MMP2MMP9
SCHEMBL28505545 0.78 CA1 (0.56) CA1CA2MMP1MMP2MMP9
SCHEMBL9711390 0.78 CYP3A4 (0.44) CA1CA2MMP1MMP2MMP9
SCHEMBL9243736 0.78 CA1 (0.56) CA1CA2MMP1MMP2MMP9
Water SCHEMBL458685 0.78 CA1 (0.56) CA1CA2MMP1MMP2MMP9
SCHEMBL2549047 0.78 CA1 (0.56) CA1CA2MMP1MMP2MMP9

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-20200323986-A1 HYDROPHOBIC ARENESULFONATE SALTS THERACAINE LLC 2020-10-15 US claimed
EP-3703686-A1 HYDROPHOBIC ARENESULFONATE SALTS Theracaine LLC (US) 2020-09-09 EP claimed
US-20200323986-A1 HYDROPHOBIC ARENESULFONATE SALTS THERACAINE LLC 2020-10-15 US disclosed
EP-3703686-A1 HYDROPHOBIC ARENESULFONATE SALTS Theracaine LLC (US) 2020-09-09 EP disclosed
EP-2066659-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2013-08-28 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-20200323986-A1 HYDROPHOBIC ARENESULFONATE SALTS ARSA, SLC26A3, ABCB11 CA1 3120/4885CA2 1120/4885MMP1 2814/4885

“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.