SCHEMBL6771108

SCHEMBL6771108

O=C(NO)C1(NS(=O)(=O)c2ccc3c(c2)oc2ccccc23)CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 14/20 0.51
▸ MMP13 P45452 14/20 0.51
▸ ADAM17 P78536 4/20 0.50
▸ USP2 O75604 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL6770863 0.90 MMP1 (0.60) MMP1MMP13
SCHEMBL6772598 0.89 HTT (0.55) MMP13ADAM17USP2HTTALDH1A1
Hydroxyamine SCHEMBL7578513 0.87 HTT (0.53) MMP13ADAM17USP2HTTALDH1A1
SCHEMBL6771478 0.85 MMP1 (0.47) MMP1MMP13ADAM17
SCHEMBL6777349 0.84 MMP1 (0.51) MMP1MMP13ADAM17USP2HTT
SCHEMBL6767794 0.84 MMP1 (0.51) MMP1MMP13ADAM17USP2HTT
SCHEMBL6771228 0.83 MMP1 (0.50) MMP1MMP13ADAM17
SCHEMBL6778949 0.82 MMP1 (0.49) MMP1MMP13ADAM17
SCHEMBL7065810 0.82 SMN1; SMN2 (0.55) MMP13USP2HTTALDH1A1LMNA
SCHEMBL1771259 0.79 MMP1 (0.62) MMP1MMP13ADAM17USP2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1210326-B1 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-02-25 — — EP claimed
US-6677355-B1 DIBENZOFURAN-3-(SULFONYLAMINO OR SULFINAMINO) DERIVATIVES; MULTIPLE SCLEROSIS, ATHEROSCLEROSIS, HEART FAILURE, PERIODONTAL DISEASE, OSTEOARTHRITIS, AUTOIMMUNE DISEASE; ANTICARCINOGENIC AGENTS WARNER-LAMBERT COMPANY 2004-01-13 — — US claimed
EP-1210326-A2 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-06-05 — — EP claimed
WO-2001012592-A2 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-02-22 — — WO claimed
EP-1210326-B1 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-02-25 — — EP disclosed
US-6677355-B1 DIBENZOFURAN-3-(SULFONYLAMINO OR SULFINAMINO) DERIVATIVES; MULTIPLE SCLEROSIS, ATHEROSCLEROSIS, HEART FAILURE, PERIODONTAL DISEASE, OSTEOARTHRITIS, AUTOIMMUNE DISEASE; ANTICARCINOGENIC AGENTS WARNER-LAMBERT COMPANY 2004-01-13 — — US disclosed
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