SCHEMBL8891603

SCHEMBL8891603

CCN(CC)C1CC1c1cccc(OC)c1

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.56
HTR2A P28223 2/20 0.56
HTR2B P41595 2/20 0.56
DRD2 P14416 1/20 0.48
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
CHRM3 P20309 1/20 0.47
KDM1A O60341 1/20 0.46
RCOR1 Q9UKL0 1/20 0.46
SLC9A1 P19634 1/20 0.45

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
SCHEMBL8891319 0.88 HTR2A (0.54) HTR2CHTR2AHTR2B
SCHEMBL8890619 0.78 HTR2A (0.50) HTR2CHTR2AHTR2BDRD2
SCHEMBL8332736 0.78 HTR2C (0.49) HTR2CHTR2AHTR2BDRD2CHRM2
SCHEMBL8330683 0.78 HTR2A (0.49) HTR2CHTR2AHTR2BCHRM2CHRM1
SCHEMBL8331305 0.78 HTR2A (0.46) HTR2CHTR2AHTR2BDRD2CHRM2
SCHEMBL15767672 0.77 SIGMAR1 (0.45) HTR2CKDM1ARCOR1
SCHEMBL23995531 0.76 HTR2C (0.74) HTR2CHTR2AHTR2BDRD2CHRM2
SCHEMBL22334915 0.76 HTR2C (0.74) HTR2CHTR2AHTR2BDRD2CHRM2
SCHEMBL20205056 0.76 HTR2C (0.74) HTR2CHTR2AHTR2BDRD2CHRM2
SCHEMBL8332882 0.76 HTR2A (0.47) HTR2CHTR2AHTR2BDRD2CHRM2

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