SCHEMBL7486252

SCHEMBL7486252

CCCCOC(=O)N(C(=O)Nc1ccc2[nH]cc(C3CCN(C)CC3)c2c1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 15/20 0.58
HTR1B P28222 14/20 0.58
HTR1A P08908 2/20 0.57
HTR1F P30939 2/20 0.57
HTR6 P50406 2/20 0.48
APP P05067 1/20 0.47
MAPT P10636 1/20 0.45
BLM P54132 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CHRM2 P08172 1/20 0.45
DRD2 P14416 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
SCHEMBL8608763 0.92 HTR1D (0.51) HTR1DHTR1BHTR1AHTR1FHTR6
SCHEMBL30908972 0.85 HTR1D (0.47) HTR1DHTR1BHTR1AHTR1FCHRM2
SCHEMBL7489102 0.85 HTR1D (0.47) HTR1DHTR1BHTR1AHTR1FCHRM2
SCHEMBL7480890 0.85 HTR1D (0.70) HTR1DHTR1BHTR1AHTR1FHTR6
SCHEMBL7478691 0.84 HTR1D (0.63) HTR1DHTR1BHTR1AHTR1FHTR6
SCHEMBL30908980 0.84 HTR1D (0.63) HTR1DHTR1BHTR1AHTR1FHTR6
SCHEMBL30909121 0.83 HTR1D (0.50) HTR1DHTR1BHTR1AHTR1FHTR6
SCHEMBL7543125 0.83 HTR1D (0.50) HTR1DHTR1BHTR1AHTR1FHTR6
SCHEMBL8386857 0.83 HTR1D (0.45) HTR1DHTR1BHTR1AHTR1F
SCHEMBL30908858 0.83 HTR1D (0.45) HTR1DHTR1BHTR1AHTR1F

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
EP-0733628-B9 5-Substituted-3-(1,2,3,6-tetrahydropyridin-4-yl)- and 3-(piperidin-4-yl)-1H-indoles: 5-HT1F agonists LILLY CO ELI (US) 2002-06-12 EP disclosed
US-6380201-B1 Methods of treating or ameliorating the symptoms of common cold or allergic rhinitis with serotonin 5-HT1F agonists ELI LILLY AND COMPANY 2002-04-30 US disclosed
EP-0733628-B1 5-Substituted-3-(1,2,3,6-tetrahydropyridin-4-yl)- and 3-(piperidin-4-yl)-1H-indoles: 5-HT1F agonists LILLY CO ELI (US) 2000-12-27 EP disclosed
US-5962473-A Methods of treating or ameliorating the symptoms of common cold or allergic rhinitis with serotonin 5-HT1F ELI LILLY AND COMPANY (US) 1999-10-05 US disclosed
US-5962474-A ANALGESICS; HEADACHES ELI LILLY AND COMPANY (US) 1999-10-05 US disclosed
EP-0832650-A2 Use of serotonin 5-HT1F agonists for the prevention of migraine ELI LILLY AND COMPANY (US) 1998-04-01 EP disclosed
EP-0824917-A2 Use of a serotonin 5-HTlf agonist in the manufacture of a medicament for treating or ameliorating the symptoms of common cold or allergic rhinitis ELI LILLY AND COMPANY (US) 1998-02-25 EP disclosed
US-5708008-A TREATMENT OF MIGRAINE ELI LILLY AND COMPANY (US) 1998-01-13 US disclosed
WO-1996029075-A1 5-SUBSTITUTED-3-(1,2,3,6-TETRAHYDROPYRIDIN-4-YL)- AND 3-(PIPERIDIN-4-YL)-1H-INDOLES: NEW 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 1996-09-26 WO disclosed
EP-0733628-A1 5-Substituted-3-(1,2,3,6-tetrahydropyridin-4-yl)- and 3-(piperidin-4-yl)-1h-indoles: new 5-ht1f agonists ELI LILLY AND COMPANY (US) 1996-09-25 EP disclosed