SCHEMBL8877360

SCHEMBL8877360

CN(C)C1CCc2cccc(C=S)c2C1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.61
CHRM2 P08172 1/20 0.60
CHRM1 P11229 1/20 0.60
DRD2 P14416 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
HTR1A P08908 10/20 0.47
HTR7 P34969 10/20 0.47
HTR1D P28221 5/20 0.46
HTR1B P28222 4/20 0.46

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
SCHEMBL6542148 0.85 CHRM3 (0.61) CHRM3CHRM2CHRM1DRD2DRD4
SCHEMBL6902920 0.82 HTR1A (0.66) DRD2DRD3HTR1AHTR7HTR1D
SCHEMBL8877592 0.82 HTR1A (0.66) DRD2DRD3HTR1AHTR7HTR1D
SCHEMBL8878188 0.82 HTR1A (0.66) DRD2DRD3HTR1AHTR7HTR1D
SCHEMBL9858674 0.81 CHRM3 (0.57) CHRM3CHRM2CHRM1DRD2DRD4
Hydrochloric Acid SCHEMBL8875673 0.81 HTR1A (0.64) DRD2DRD3HTR1AHTR7HTR1D
Hydrochloric Acid SCHEMBL8875802 0.81 HTR1A (0.64) DRD2DRD3HTR1AHTR7HTR1D
Hydrochloric Acid SCHEMBL9858320 0.80 CHRM3 (0.56) CHRM3CHRM2CHRM1DRD2DRD4
SCHEMBL14591308 0.78 CHRM3 (0.69) CHRM3CHRM2CHRM1DRD2DRD4
SCHEMBL5361640 0.76 CHRM3 (0.67) CHRM3CHRM2CHRM1DRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5637624-A ANTISEROTONIN AGENT ELI LILLY AND COMPANY (US) 1997-06-10 US disclosed
US-5594034-A ADMINISTERING DIRECT ACTING 5-HYDROXYTRYPTAMINE AGONIST TO MAMMAL ELI LILLY AND COMPANY (US) 1997-01-14 US disclosed
US-5594025-A Method of inhibiting gastric acid secretion with 5-substituted-3-aminochromane ELI LILLY AND COMPANY (US) 1997-01-14 US disclosed
EP-0455510-B1 Use of 5-HT1A receptor agonist compounds for inhibiting gastric acid secretion LILLY CO ELI (US) 1996-11-27 EP disclosed
US-5576352-A Method of inhibiting gastric acid secretion with aryloxypropanolamines ELI LILLY AND COMPANY (US) 1996-11-19 US disclosed
US-5457120-A Antisecretory and antiserotonine agents ELI LILLY AND COMPANY (US) 1995-10-10 US disclosed
EP-0385658-B1 Ring-substituted 2-amino 1,2,3,4-tetra-hydronaphthalenes and 3-aminochromanes LILLY CO ELI (US) 1994-12-28 EP disclosed
US-5340838-A Administering serotonin agonist to mammals ELI LILLY AND COMPANY (US) 1994-08-23 US disclosed
US-5258379-A ADMINISTERING IN AN EFFECTIVE DOSAGE TO MAMMALS ELI LILLY AND COMPANY (US) 1993-11-02 US disclosed
US-5158956-A Administering serotonin receptor agonist ELI LILLY AND COMPANY (US) 1992-10-27 US disclosed
US-5096908-A 5-HT1A agonist ELI LILLY AND COMPANY (US) 1992-03-17 US disclosed
EP-0455510-A2 Use of 5-HT1A receptor agonist compounds for inhibiting gastric acid secretion ELI LILLY AND COMPANY (US) 1991-11-06 EP disclosed
EP-0385658-A1 Ring-substituted 2-amino 1,2,3,4-tetra-hydronaphthalenes and 3-aminochromanes ELI LILLY AND COMPANY (US) 1990-09-05 EP disclosed