SCHEMBL1370146

SCHEMBL1370146

Cc1cccnc1N1CCC(=O)CC1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
HSD11B1 P28845 1/20 0.54
TRPV1 Q8NER1 2/20 0.48
PARP1 P09874 2/20 0.43
MALT1 Q9UDY8 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
F13A1 P00488 1/20 0.42
TGM2 P21980 1/20 0.42
TGM1 P22735 1/20 0.42
TGM3 Q08188 1/20 0.42
TNK2 Q07912 1/20 0.42
TNK1 Q13470 1/20 0.42
ELANE P08246 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
SCHEMBL3436626 0.83 HSD11B1 (0.48) LMNAHSD11B1TRPV1PARP1TNK2
SCHEMBL11962834 0.82 HSD11B1 (0.55) HSD11B1TRPV1
SCHEMBL18228586 0.82 HSD11B1 (0.55) HSD11B1TRPV1
SCHEMBL15966094 0.82 HSD11B1 (0.55) HSD11B1TRPV1
SCHEMBL2614921 0.80 CYP1A2 (0.56) LMNAHSD11B1TRPV1
SCHEMBL13271105 0.80 LMNA (0.56) LMNAHSD11B1MALT1ELANE
SCHEMBL8299219 0.79 LMNA (0.59) LMNAHSD11B1TRPV1MALT1
SCHEMBL2844754 0.79 LMNA (0.59) LMNAHSD11B1TRPV1
SCHEMBL5178342 0.79 HSD11B1 (0.56) HSD11B1TRPV1ELANE
SCHEMBL1368883 0.79 LMNA (0.47) LMNAHSD11B1TRPV1MALT1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110288129-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2011-11-24 US disclosed
US-7998982-B2 Amide derivatives as TRPV1 antagonists ABBOTT LABORATORIES (US) 2011-08-16 US disclosed
US-7964602-B2 Biaryl compounds useful as agonists of the Gpr38 receptor GLAXO GROUP LIMITED (GB) 2011-06-21 US disclosed
CN-101801953-A Tetrahydropyridyl carboxamide derivatives as TRPV1 antagonists ABBOTT LAB 2010-08-11 CN disclosed
EP-2185538-A2 TETRAHYDROPYRIDINE CARBOXAMIDE DERIVATIVES AS TRPVL ANTAGONISTS Abbott Laboratories (US) 2010-05-19 EP disclosed
US-20090062345-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2009-03-05 US disclosed
WO-2009023539-A2 TETRAHYDROPYRIDINE CARBOXAMIDE DERIVATIVES AS TRPVL ANTAGONISTS ABBOTT LABORATORIES (US) 2009-02-19 WO disclosed
US-20080306083-A1 Biaryl Compounds Useful as Agonists of the Gpr38 Receptor GLAXO GROUP LIMITED 2008-12-11 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-20090062345-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS TRPV1, TRPV3, TRPA1 LMNA 3948/4885HSD11B1 3218/4885TRPV1 1/4885
US-20080306083-A1 Biaryl Compounds Useful as Agonists of the Gpr38 Receptor GPR88, GPR68, GPBAR1 LMNA 3645/4885HSD11B1 789/4885TRPV1 159/4885
US-20110288129-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS TRPV1, TRPV3, TRPA1 LMNA 3948/4885HSD11B1 3218/4885TRPV1 1/4885

“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.