SCHEMBL7614562

SCHEMBL7614562

CN1CCC=C(c2nsnc2SCCCC(OC(=O)C(=O)OC(CCCSc2nsnc2C2=CCCN(C)C2)Sc2nnnn2C)Sc2nnnn2C)C1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 11/20 0.58
CHRM4 P08173 3/20 0.57
SIGMAR1 Q99720 1/20 0.55

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
SCHEMBL7610832 0.98 CHRM1 (0.60) CHRM1CHRM4
SCHEMBL7614590 0.97 CHRM1 (0.60) CHRM1CHRM4
Oxalic Acid SCHEMBL7614557 0.84 CHRM1 (0.69) CHRM1CHRM4
SCHEMBL7617535 0.84 CHRM1 (0.58) CHRM1CHRM4SIGMAR1
SCHEMBL7611994 0.83 CHRM1 (0.77) CHRM1CHRM4SIGMAR1
Oxalic Acid SCHEMBL7614588 0.83 CHRM1 (0.69) CHRM1CHRM4
Oxalic Acid SCHEMBL7610828 0.83 CHRM1 (0.69) CHRM1CHRM4
SCHEMBL7620935 0.83 CHRM1 (0.59) CHRM1CHRM4SIGMAR1
SCHEMBL7617889 0.83 CHRM1 (0.55) CHRM1CHRM4SIGMAR1
SCHEMBL7617463 0.82 CHRM1 (0.78) CHRM1CHRM4SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0734259-B1 Use of piperidine compounds in the treatment of schizophrenia NOVO NORDISK AS (DK) 2002-06-12 EP disclosed
US-5773452-A ALZHEIMER'S DISEASE; COGNITION ACTIVATORS NOVO NORDISK ALS (DK) 1998-06-30 US disclosed
US-5753683-A SCHIZOPHRENIA NOVO NORDISK A/S (DK) 1998-05-19 US disclosed
US-5750541-A 3-(1,2,5-THIA OR OXADIAZOL-3-YL)-1,2,5,6-PYRIDINE DERIVATIVES; SCHIZOPHRENIFORM DISEASES; SIDE EFFECT REDUCTION NOVO NORDISK A/S (DK) 1998-05-12 US disclosed
US-5744489-A ADMINISTERING CERTAIN 1,2,5-THIADIAZOLE AND 1,2,5-OXADIAZOLE COMPOUNDS GREENWOOD BEVERLEY (US) 1998-04-28 US disclosed
EP-0732925-A1 A METHOD OF TREATING GASTROINTESTINAL MOTILITY DISORDERS NOVO NORDISK A/S (DK) 1996-09-25 EP disclosed
WO-1995017185-A1 A METHOD OF TREATING GASTROINTESTINAL MOTILITY DISORDERS NOVO NORDISK A/S (DK) 1995-06-29 WO disclosed