SCHEMBL2603228

SCHEMBL2603228

CC(C)C1CCN(C(=O)CNS(C)(=O)=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.50
PREP P48147 1/20 0.50
FAP Q12884 1/20 0.50
TLR9 Q9NR96 1/20 0.41
TLR8 Q9NR97 1/20 0.41
TLR7 Q9NYK1 1/20 0.41
HCRTR2 O43614 11/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL2603246 0.85 HSD11B1 (0.43) DPP4PREPFAPHCRTR2ALDH1A1
SCHEMBL2606051 0.82 ALDH1A1 (0.54) DPP4PREPFAPTLR9TLR8
SCHEMBL2603231 0.80 EPHX2 (0.38) TLR9TLR8TLR7ALDH1A1POLB
SCHEMBL23553276 0.79 DPP4 (0.48) DPP4PREPFAPTLR9TLR8
SCHEMBL2603262 0.78 TDP1 (0.43) DPP4HCRTR2
SCHEMBL23573343 0.77 DPP4 (0.46) DPP4PREPFAPTLR9TLR8
SCHEMBL20381496 0.76 DPP4 (0.45) DPP4TLR9TLR8TLR7ALDH1A1
SCHEMBL12876398 0.76 EPHX2 (0.50) ALDH1A1
SCHEMBL13779909 0.75 DPP4 (0.45) DPP4PREPFAPL3MBTL1
SCHEMBL12125446 0.75 CPN1 (0.41) HCRTR2ALDH1A1POLBNPSR1L3MBTL1

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
US-8362008-B2 Amido-thiophene compounds and their use as 11-beta-HSD1 inhibitors THE UNIVERSITY OF EDINBURGH (GB) 2013-01-29 US disclosed
US-20120095046-A1 Amido-Isothiazole Compounds and Their Use as Inhibitors of 11Beta-HSD1 for the Treatment of Metabolic Syndrome and Related Disorders THE UNIVERSITY OF EDINBURGH (GB) 2012-04-19 US disclosed
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors THE UNIVERSITY OF EDINBURGH 2010-10-21 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 (2 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-20120095046-A1 Amido-Isothiazole Compounds and Their Use as Inhibitors of 11Beta-HSD1 for the Treatment of Metabolic Syndrome and Related Disorders HSD11B1, HSD11B2, HSD3B1 DPP4 434/4885PREP 2942/4885FAP 4583/4885
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors HSD11B1, HSD11B2, HSD17B1 DPP4 251/4885PREP 1409/4885FAP 3884/4885

“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.