SCHEMBL4375455

SCHEMBL4375455

CCCN1CCCC1CN

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.41
S1PR3 Q99500 3/20 0.41
S1PR5 Q9H228 3/20 0.41
S1PR4 O95977 1/20 0.41
SPHK2 Q9NRA0 2/20 0.39
SPHK1 Q9NYA1 2/20 0.39
HTT P42858 2/20 0.36
NCF1 P14598 1/20 0.35
DRD3 P35462 2/20 0.35
OPRD1 P41143 1/20 0.35
CYP2D6 P10635 1/20 0.35
DRD2 P14416 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL9155196 1.00 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL4372918 0.94 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL4370595 0.92 S1PR1 (0.40) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL856300 0.88 S1PR1 (0.49) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL7278231 0.88 S1PR1 (0.49) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL7277972 0.88 S1PR1 (0.49) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL1906108 0.86 S1PR1 (0.55) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL7269965 0.85 S1PR1 (0.57) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL7269957 0.85 S1PR1 (0.57) S1PR1S1PR3S1PR5S1PR4SPHK2
SCHEMBL299670 0.83

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0091528-B1 -N-(1-PROPYL-2-PYRROLIDYLMETHYL)-2-METHOXY-5-SULFAMOYL BENZAMIDE AND ITS USE AGAINST SOME SORTS OF DEPRESSION SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1986-07-23 EP claimed
US-8212037-B2 Process for production of optically active quinuclidinols KANTO KAGAKU KABUSHIKI KAISHA (JP) 2012-07-03 US disclosed
US-20090216019-A1 Process for Production of Optically Active Quinuclidinols KANTO KAGAKU KABUSHIKI KAISHA 2009-08-27 US disclosed
EP-1867654-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE QUINUCLIDINOL Nagoya Industrial Science Research Institute (JP) 2007-12-19 EP disclosed
US-5468876-A Intermediates for the stereoconservative synthesis of 1-substituted (S)-and (R)-2-aminomethylpyrrolidines AKTIEBOLAGET ASTRA (SE) 1995-11-21 US disclosed
US-5300660-A Efficient stereoconservative synthesis of 1-substituted (S)- and (R)-2-aminomethylpyrrolidines and intermediates thereto ASTRA LAKEMEDEL AKTIEBOLAG (SE) 1994-04-05 US disclosed
EP-0253785-B1 EFFICIENT STEREOCONSERVATIVE SYNTHESES OF 1-SUBSTITUTED (S)- AND (R)-2-AMINOMETHYLPYRROLIDINES AND INTERMEDIATES THEREIN ASTRA LAKEMEDEL AKTIEBOLAG (SE) 1992-11-11 EP disclosed
EP-0236646-B1 ORTHO-ANISAMIDES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL APPLICATIONS Laboratoires DELAGRANGE, Société Anonyme (FR) 1990-10-10 EP disclosed
US-4914117-A ANTIDEPRESSANTS, CENTRAL NERVOUS SYSTEM ACTIVATORS; DOPAMINE ANTAGONISTS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLE DE L'ILE-D-FRANCE (FR) 1990-04-03 US disclosed
US-4835172-A Novel benzamides, intermediates and process for the preparation and therapeutic use thereof SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1989-05-30 US disclosed
US-4695574-A HYPOTENSIVE AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1987-09-22 US disclosed
EP-0236646-A1 Ortho-anisamides, process for their preparation and their pharmaceutical applications Laboratoires DELAGRANGE, Société Anonyme (FR) 1987-09-16 EP disclosed
US-4617314-A Benzofuran- and benzopyran-carboxamide derivatives YOSHITOMI PHARMACEUTICAL INDUSTRIES LTD. (JP) 1986-10-14 US disclosed
EP-0091528-B1 -N-(1-PROPYL-2-PYRROLIDYLMETHYL)-2-METHOXY-5-SULFAMOYL BENZAMIDE AND ITS USE AGAINST SOME SORTS OF DEPRESSION SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1986-07-23 EP disclosed
EP-0060235-B1 BENZAMIDO-DERIVATIVES Astra Läkemedel Aktiebolag (SE) 1986-01-08 EP disclosed
EP-0124783-A1 Benzofuran- and benzopyran-carboxamide derivatives Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1984-11-14 EP disclosed
EP-0091528-A1 -N-(1-propyl-2-pyrrolidylmethyl)-2-methoxy-5-sulfamoyl benzamide and its use against some sorts of depression SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1983-10-19 EP disclosed
EP-0091528-A1 -N-(1-propyl-2-pyrrolidylmethyl)-2-methoxy-5-sulfamoyl benzamide and its use against some sorts of depression SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1983-10-19 EP disclosed
EP-0060235-A1 Benzamido-derivatives Astra Läkemedel Aktiebolag (SE) 1982-09-15 EP disclosed
US-3959477-A Methods of protection against emesis in mammals by administration of a heterocyclic benzamide SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1976-05-25 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 (1 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-20090216019-A1 Process for Production of Optically Active Quinuclidinols NQO2, ADH7, MRPL21 S1PR1 4815/4885S1PR3 4725/4885S1PR5 4748/4885

“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.