SCHEMBL8890619

SCHEMBL8890619

CCN(CC)C1CC1c1cccc(O)c1

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
DRD2 P14416 3/20 0.46
DRD3 P35462 3/20 0.44
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
HTR1A P08908 1/20 0.43
DRD1 P21728 1/20 0.43
DRD4 P21917 1/20 0.43
DRD5 P21918 1/20 0.43

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
SCHEMBL8890510 0.88
SCHEMBL9003716 0.81 HTR2A (0.50) HTR2AHTR2CHTR2BCHRNB4CHRNA3
SCHEMBL15767672 0.79 SIGMAR1 (0.45) HTR2CDRD3HTR1A
SCHEMBL8891603 0.78 HTR2C (0.56) HTR2AHTR2CHTR2BDRD2
Hydrochloric Acid SCHEMBL15766814 0.78 SIGMAR1 (0.46) HTR2AHTR2CHTR2B
SCHEMBL8331359 0.76 HTR2A (0.43) HTR2AHTR2CHTR2BDRD2DRD3
SCHEMBL23923443 0.73 HTR2A (0.56) HTR2AHTR2CHTR2BCHRNB4CHRNA3
SCHEMBL23923444 0.73 HTR2A (0.56) HTR2AHTR2CHTR2BCHRNB4CHRNA3
SCHEMBL23923588 0.73 HTR2A (0.56) HTR2AHTR2CHTR2BCHRNB4CHRNA3
SCHEMBL23940041 0.73 HTR2A (0.56) HTR2AHTR2CHTR2BCHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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