SCHEMBL1795653

SCHEMBL1795653

CN1CCCC[C@@H]1C(N)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 2/20 0.50
CHRNA3 P32297 2/20 0.50
OPRM1 P35372 4/20 0.49
OPRD1 P41143 4/20 0.49
OPRK1 P41145 4/20 0.49
OPRL1 P41146 4/20 0.49
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
CHRM3 P20309 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
SCHEMBL1795410 1.00 CHRNB4 (0.50) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL1797151 1.00 CHRNB4 (0.50) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL1794388 1.00 CHRNB4 (0.50) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL1797148 1.00 CHRNB4 (0.50) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL13403267 0.98 CHRNB4 (0.49) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL31568823 0.95 CHRNB4 (0.55) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL13403254 0.95 CHRNB4 (0.55) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL5187982 0.95 CHRNB4 (0.55) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL3538856 0.95 CHRNB4 (0.55) CHRNB4CHRNA3OPRM1OPRD1OPRK1
SCHEMBL3538855 0.95 CHRNB4 (0.55) CHRNB4CHRNA3OPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951821-B2 Devoided of activity on the opiate or 5-HT3 receptors, exhibit a particular activity as specific inhibitors of the glycine transporters glyt1 and/or glyt2; 2-Chloro-N-[(S)-phenyl-[(2S)-piperidin-2-yl]methyl]-3-(trifluoromethyl)benzamide SANOFI-AVENTIS (FR) 2011-05-31 US disclosed
US-7326722-B2 N-[Phenyl(piperidin-2-yl)methyl]benzamide derivatives, their preparation and their application in therapy SANOFI-AVENTIS (FR) 2008-02-05 US disclosed
EP-1527048-B1 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY SANOFI AVENTIS (FR) 2008-01-09 EP disclosed
US-20070197601-A1 Use of N-[Phenyl(piperidin-2-yl)methyl]benzamide derivatives in therapy SANOFI-AVENTIS (FR) 2007-08-23 US disclosed
US-20070155789-A1 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2007-07-05 US disclosed
EP-1499589-B1 DERIVATIVES OF N-PHENYL(PIPERIDIN-2-YL)METHYL BENZAMIDE, THE PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2007-05-02 EP disclosed
US-7205319-B2 exhibit a particular activity as specific inhibitors of the glycine transporters glyt1 and/or glyt2 SANOFI-AVENTIS (FR) 2007-04-17 US disclosed
US-20050159450-A1 Derivative of n-[phenyl(piperidin-2-yl)methyl]benzamide, the preparation method thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2005-07-21 US disclosed
US-20050153963-A1 N-[phenyl (piperidin-2-yl) methyl]benzamide derivatives, preparation thereof, and use thereof in therapy SANOFI-AVENTIS (FR) 2005-07-14 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 (4 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-20070197601-A1 Use of N-[Phenyl(piperidin-2-yl)methyl]benzamide derivatives in therapy SLC1A2, SLC1A1, SLC1A5 CHRNB4 3163/4885CHRNA3 2646/4885OPRM1 1288/4885
US-20050153963-A1 N-[phenyl (piperidin-2-yl) methyl]benzamide derivatives, preparation thereof, and use thereof in therapy HDAC6, NAT1, ARG2 CHRNB4 2960/4885CHRNA3 2216/4885OPRM1 175/4885
US-20050159450-A1 Derivative of n-[phenyl(piperidin-2-yl)methyl]benzamide, the preparation method thereof and application of same in therapeutics NPR3, NR4A3, PRMT3 CHRNB4 389/4885CHRNA3 185/4885OPRM1 66/4885
US-20070155789-A1 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY HDAC6, NAT1, ARG2 CHRNB4 2960/4885CHRNA3 2216/4885OPRM1 175/4885

“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.