SCHEMBL12627108

SCHEMBL12627108

CCc1ccc(S(=O)(=O)N2CCOC23CCN(C(=O)OC(C)(C)C)CC3)cc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 1/20 0.48
▸ HCRTR2 O43614 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ NAMPT P43490 2/20 0.45
▸ GPR119 Q8TDV5 3/20 0.43
▸ F13A1 P00488 1/20 0.42
▸ TGM2 P21980 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
SCHEMBL12623931 0.92 HCRTR1 (0.48) HCRTR1HCRTR2L3MBTL1ALDH1A1NAMPT
SCHEMBL15426422 0.89 HCRTR1 (0.51) HCRTR1HCRTR2L3MBTL1ALDH1A1GPR119
SCHEMBL12627185 0.88 HCRTR1 (0.50) HCRTR1HCRTR2L3MBTL1ALDH1A1
SCHEMBL12655883 0.88 HCRTR1 (0.50) HCRTR1HCRTR2L3MBTL1ALDH1A1NAMPT
SCHEMBL12656193 0.87 L3MBTL1 (0.57) HCRTR1HCRTR2L3MBTL1ALDH1A1GPR119
SCHEMBL15426424 0.86 HCRTR1 (0.48) HCRTR1HCRTR2L3MBTL1ALDH1A1F13A1
SCHEMBL21202626 0.80 HCRTR1 (0.49) HCRTR1HCRTR2L3MBTL1ALDH1A1
SCHEMBL12626973 0.80 USP2 (0.46) HCRTR1HCRTR2NAMPTGPR119
SCHEMBL22368466 0.80 L3MBTL1 (0.52) HCRTR1HCRTR2L3MBTL1ALDH1A1
SCHEMBL20365037 0.80 HCRTR1 (0.50) HCRTR1HCRTR2L3MBTL1ALDH1A1

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-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
US-8653068-B2 Filamin A binding anti-inflammatory and analgesic PAIN THERAPEUTICS, INC. (US) 2014-02-18 — — 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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 HCRTR1 3880/4885HCRTR2 3876/4885L3MBTL1 3291/4885
US-20110105487-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC FLNA, FLNB, FPR1 HCRTR1 4172/4885HCRTR2 4089/4885L3MBTL1 4055/4885
US-20110105481-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC FLNA, FLNB, OPRK1 HCRTR1 3880/4885HCRTR2 3876/4885L3MBTL1 3291/4885

“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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