SCHEMBL8891319

SCHEMBL8891319

CCCN(CCC)C1CC1c1cccc(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.54
HTR2C P28335 2/20 0.54
HTR2B P41595 2/20 0.54

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
SCHEMBL8891603 0.88 HTR2C (0.56) HTR2AHTR2CHTR2B
SCHEMBL8890510 0.79
SCHEMBL8332882 0.77 HTR2A (0.47) HTR2AHTR2CHTR2B
SCHEMBL8329351 0.77 HTR2A (0.47) HTR2AHTR2CHTR2B
SCHEMBL8332736 0.76 HTR2C (0.49) HTR2AHTR2CHTR2B
SCHEMBL8330683 0.76 HTR2A (0.49) HTR2AHTR2CHTR2B
SCHEMBL8331305 0.76 HTR2A (0.46) HTR2AHTR2CHTR2B
SCHEMBL23995531 0.74 HTR2C (0.74) HTR2AHTR2CHTR2B
SCHEMBL22334915 0.74 HTR2C (0.74) HTR2AHTR2CHTR2B
SCHEMBL20205056 0.74 HTR2C (0.74) HTR2AHTR2CHTR2B

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 8 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
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