SCHEMBL1794708

SCHEMBL1794708

OC(c1ccccc1)[C@@H]1CCCCN1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.62
SLC6A2 P23975 5/20 0.62
SLC6A4 P31645 4/20 0.62
HIF1A Q16665 1/20 0.61
HSD17B10 Q99714 1/20 0.61
DHFR P00374 1/20 0.57
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56

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
SCHEMBL1533285 1.00 SLC6A3 (0.62) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL1794707 1.00 SLC6A3 (0.62) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL13403260 0.98 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20439223 0.94 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL6674308 0.94 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL5177411 0.94 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20482420 0.94 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20482130 0.94 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20482096 0.94 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL9872556 0.94 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10

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 11 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
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-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
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-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
EP-1527048-A2 N- PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY Sanofi-Aventis (FR) 2005-05-04 EP disclosed
WO-2004013101-A2 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2004-02-12 WO disclosed
WO-2004013100-A2 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2004-02-12 WO disclosed
EP-0572449-A1 (AMIDOMETHYL)NITROGEN HETEROCYCLIC ANALGESICS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-12-08 EP disclosed
US-5254569-A Side effect reduction; diuretics; anticonvulsants THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-10-19 US disclosed
WO-1992012128-A1 (AMIDOMETHYL)NITROGEN HETEROCYCLIC ANALGESICS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-07-23 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 (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-20050153963-A1 N-[phenyl (piperidin-2-yl) methyl]benzamide derivatives, preparation thereof, and use thereof in therapy HDAC6, NAT1, ARG2 SLC6A3 1390/4885SLC6A2 1222/4885SLC6A4 1290/4885
US-20070155789-A1 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY HDAC6, NAT1, ARG2 SLC6A3 1390/4885SLC6A2 1222/4885SLC6A4 1290/4885

“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.