SCHEMBL12626531

SCHEMBL12626531

COc1ccc(S(=O)(=O)N2CCOC23CCCN(C(=O)OC(C)(C)C)C3)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 3/20 0.50
▸ MMP9 P14780 3/20 0.50
▸ MMP13 P45452 3/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ MMP3 P08254 2/20 0.47
▸ MMP7 P09237 2/20 0.47
▸ STS P08842 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ HCRTR1 O43613 1/20 0.43
▸ HCRTR2 O43614 1/20 0.43
▸ MMP2 P08253 2/20 0.42
▸ MMP14 P50281 1/20 0.42
▸ ADAM17 P78536 1/20 0.42
▸ NAMPT P43490 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ MMP8 P22894 1/20 0.41

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
SCHEMBL12627276 0.90 L3MBTL1 (0.47) MMP1MMP9MMP13L3MBTL1ALDH1A1
SCHEMBL12656193 0.88 L3MBTL1 (0.57) MMP1MMP9MMP13L3MBTL1MMP3
SCHEMBL12621739 0.80 L3MBTL1 (0.60) L3MBTL1ALDH1A1PKM
SCHEMBL21202627 0.78 L3MBTL1 (0.53) L3MBTL1ALDH1A1
SCHEMBL15694914 0.78 L3MBTL1 (0.53) MMP1MMP9L3MBTL1MMP3MMP7
SCHEMBL15426422 0.78 HCRTR1 (0.51) MMP13L3MBTL1ALDH1A1HCRTR1HCRTR2
SCHEMBL22368466 0.77 L3MBTL1 (0.52) L3MBTL1STSALDH1A1HCRTR1HCRTR2
SCHEMBL12627185 0.77 HCRTR1 (0.50) MMP13L3MBTL1ALDH1A1HCRTR1HCRTR2
SCHEMBL12655883 0.77 HCRTR1 (0.50) L3MBTL1ALDH1A1HCRTR1HCRTR2NAMPT
SCHEMBL13352646 0.76 STS (0.56) MMP1MMP9MMP13MMP3MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2918587-B1 Filamin A binding compounds and their use as anti-inflammatory and analgesic agents PAIN THERAPEUTICS INC (US) 2018-04-04 — — EP disclosed
EP-2488177-B1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC PAIN THERAPEUTICS INC (US) 2016-10-12 — — EP disclosed
US-20160251374-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC BURNS BARBIER LINDSAY (US) 2016-09-01 — — US disclosed
US-9340558-B2 Filamin a binding anti-inflammatory and analgesic PAIN THERAPEUTICS INC. (US) 2016-05-17 — — US disclosed
EP-2918587-A2 Filamin a binding anti-inflammatory and analgesic Pain Therapeutics, Inc. (US) 2015-09-16 — — EP disclosed
US-8653068-B2 Filamin A binding anti-inflammatory and analgesic PAIN THERAPEUTICS, INC. (US) 2014-02-18 — — US disclosed
US-8580809-B2 Filamin A-binding anti-inflammatory analgesic PAIN THERAPEUTICS, INC. (US) 2013-11-12 — — US disclosed
US-8580808-B2 Filamin A-binding anti-inflammatory analgesic Pain Therapeutic, Inc. (US) 2013-11-12 — — US disclosed
US-20110105484-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC PAIN THERAPEUTICS 2011-05-05 — — US disclosed
US-20110105487-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC PAIN THERAPEUTICS 2011-05-05 — — US disclosed
US-20110105481-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC PAIN THERAPEUTICS 2011-05-05 — — US disclosed
US-20110105547-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC PAIN THERAPEUTICS 2011-05-05 — — US disclosed
WO-2010051497-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC PAIN THERAPEUTICS, INC. (US) 2010-05-06 — — 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 (5 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-20160251374-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC FLNA, FLNB, OPRK1 MMP1 3476/4885MMP9 1824/4885MMP13 2215/4885
US-20110105487-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC FLNA, FLNB, FPR1 MMP1 3044/4885MMP9 1636/4885MMP13 2252/4885
US-20110105484-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC FLNA, FLNB, OPRK1 MMP1 2812/4885MMP9 1119/4885MMP13 1607/4885
US-20110105547-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC FLNA, FLNB, OPRK1 MMP1 2812/4885MMP9 1119/4885MMP13 1607/4885
US-20110105481-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC FLNA, FLNB, OPRK1 MMP1 3476/4885MMP9 1824/4885MMP13 2215/4885

“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.

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