SCHEMBL8891075

SCHEMBL8891075

CCCN(CCC)C1Cc2c[nH]c3ccc(C(O)=S)c(c23)C1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.76
HTR1D P28221 9/20 0.51
HTR1B P28222 7/20 0.51
DRD2 P14416 2/20 0.51

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
SCHEMBL8889776 0.88 HTR1A (0.83) HTR1AHTR1DHTR1BDRD2
SCHEMBL9412130 0.88 HTR1A (0.83) HTR1AHTR1DHTR1BDRD2
Ly-293284 SCHEMBL6902000 0.86 HTR1A (1.00) HTR1AHTR1DHTR1BDRD2
Ly-293284 SCHEMBL7202815 0.86 HTR1A (1.00) HTR1AHTR1DHTR1BDRD2
Ly-293284 SCHEMBL7204055 0.86 HTR1A (1.00) HTR1AHTR1DHTR1BDRD2
SCHEMBL8983347 0.85 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2
SCHEMBL6765275 0.85 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2
SCHEMBL6364891 0.85 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2
SCHEMBL7208944 0.85 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2
Oxalic Acid SCHEMBL7515265 0.84 HTR1A (0.77) HTR1AHTR1DHTR1BDRD2

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 12 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-5462962-A Administering to mammals to selectively block biological receptors to treat anxiety or depression ELI LILLY AND COMPANY (US) 1995-10-31 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-5204340-A Anxiolytic agents; antidepressants; consumptive disorders,e.g. obesity, alcoholism and smoking; sexual dysfunction ELI LILLY AND COMPANY (US) 1993-04-20 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-0392768-A1 Tetrahydrobenz[C,D] indole serotonin agonists ELI LILLY AND COMPANY (US) 1990-10-17 EP disclosed