SCHEMBL6777349

SCHEMBL6777349

O=C(NO)C1(NS(=O)(=O)c2ccc3c4c(oc3c2)CCCCCC4)CCCC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 17/20 0.51
▸ MMP13 P45452 17/20 0.51
▸ ADAM17 P78536 2/20 0.44
▸ USP2 O75604 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MMP2 P08253 1/20 0.42
▸ MMP3 P08254 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MMP8 P22894 1/20 0.42
▸ MMP12 P39900 1/20 0.42
▸ MMP14 P50281 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
SCHEMBL6767794 1.00 MMP1 (0.51) MMP1MMP13ADAM17USP2HTT
SCHEMBL6771228 0.99 MMP1 (0.50) MMP1MMP13ADAM17MMP2MMP3
SCHEMBL6778949 0.98 MMP1 (0.49) MMP1MMP13ADAM17MMP2MMP3
SCHEMBL6770822 0.90 SMN1; SMN2 (0.54) MMP1MMP13ADAM17USP2HTT
SCHEMBL6771732 0.90 SMN1; SMN2 (0.54) MMP1MMP13ADAM17USP2HTT
SCHEMBL6771728 0.89 SMN1; SMN2 (0.52) MMP1MMP13USP2HTTSMN1; SMN2
Hydroxyamine SCHEMBL7552923 0.88 SMN1; SMN2 (0.52) MMP1MMP13USP2HTTSMN1; SMN2
SCHEMBL6768081 0.86 SMN1; SMN2 (0.52) MMP1MMP13USP2HTTSMN1; SMN2
SCHEMBL6771108 0.84 MMP1 (0.51) MMP1MMP13ADAM17USP2HTT
SCHEMBL6771478 0.78 MMP1 (0.47) MMP1MMP13ADAM17MMP2MMP3

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
EP-1210326-B1 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-02-25 — — EP 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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