SCHEMBL6207817

SCHEMBL6207817

CCCCOc1ccc(-c2ccc(S(=O)(=O)CC(=O)O)s2)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 10/20 0.48
RARB P10826 4/20 0.45
MMP1 P03956 2/20 0.45
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
PLA2G4B P0C869 1/20 0.43
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
MMP7 P09237 1/20 0.43
MMP9 P14780 1/20 0.43
MMP14 P50281 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
SCHEMBL8313376 0.85 MMP13 (0.46) MMP13RARBMMP1CYP1A2CYP3A4
SCHEMBL6205985 0.81 CYP2D6 (0.49) MMP13RARBMMP1CYP1A2CYP3A4
SCHEMBL6206170 0.78 L3MBTL1 (0.47) MMP13RARBCYP1A2CYP3A4CYP2D6
SCHEMBL14569172 0.76 NPC1 (0.50) MMP13MMP1CYP1A2CYP3A4CYP2D6
SCHEMBL3255184 0.75 NPC1 (0.49) MMP13MMP1CYP1A2CYP3A4CYP2D6
SCHEMBL6206523 0.74 MMP13 (0.53) MMP13MMP1CYP1A2CYP3A4CYP2D6
SCHEMBL3255085 0.74 MMP13 (0.49) MMP13MMP1MMP2MMP3MMP7
SCHEMBL6538561 0.74 RARB (0.76) RARBPLA2G4B
SCHEMBL16552630 0.73 CYP2D6 (0.58) RARBCYP1A2CYP3A4CYP2D6PLA2G4B
SCHEMBL2355811 0.73 RARB (0.79) RARBPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1565459-A2 HETEROARYLSULFONYLMETHYL HYDROXAMIC ACIDS AND AMIDES AND THEIR USE AS PROTEASE INHIBITORS Pharmacia Corporation (US) 2005-08-24 EP disclosed
US-20040142979-A1 Heteroarylsulfonylmethyl hydroxamic acids and amides and their use as protease inhibitors PHARMACIA CORPORATION 2004-07-22 US disclosed
WO-2004048368-A2 HETEROARYLSULFONYLMETHYL HYDROXAMIC ACIDS AND AMIDES AND THEIR USE AS PROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2004-06-10 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-20040142979-A1 Heteroarylsulfonylmethyl hydroxamic acids and amides and their use as protease inhibitors MMP3, MMP13, MMP10 MMP13 2/4885RARB 4208/4885MMP1 5/4885

“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.