SCHEMBL7656963

SCHEMBL7656963

CCNC1CCc2[nH]c3ccc(NC(=O)c4cc(F)ccc4F)cc3c2C1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 1/20 0.54
HTR1A P08908 5/20 0.48
SLC6A4 P31645 1/20 0.48
HTR1B P28222 2/20 0.45
HTR1D P28221 1/20 0.45
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
HTR1E P28566 1/20 0.42
HTR7 P34969 1/20 0.42
OPRM1 P35372 1/20 0.42
TMEM97 Q5BJF2 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
VPS4B O75351 1/20 0.40
VCP P55072 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL7659583 0.93 HTR1F (0.54) HTR1FHTR1ASLC6A4HTR1BHTR1D
SCHEMBL7658867 0.90 HTR1F (0.51) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7666034 0.89 HTR1F (0.53) HTR1FHTR1ASLC6A4HTR1BHTR1D
SCHEMBL7663838 0.88 HTR1F (0.70) HTR1FHTR1AHTR1BHTR1DDRD2
Bromide SCHEMBL7664575 0.87 HTR1F (0.69) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7660703 0.86 HTR1F (0.49) HTR1FHTR1ASLC6A4HTR1BHTR1D
SCHEMBL7660816 0.86 HTR1F (0.58) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7664557 0.86 HTR1F (0.59) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7662604 0.85 HTR1F (0.57) HTR1FHTR1AHTR1BHTR1DDRD2
Oxalic Acid SCHEMBL7653789 0.85 HTR1F (0.66) HTR1FHTR1AHTR1BHTR1DDRD2

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-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-0749962-B1 6-substituted-1,2,3,4-tetrahydro-9H-carbazoles and 7-substituted-10H-cyclohepta(7,6-B)indoles LILLY CO ELI (US) 2000-11-02 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-5814653-A SUMATRIPTAN FOR RELIEF OF MIGRAINE PAIN AND OTHER DISORDERS ASSOCIATED WITH PEPTIDE EXTRAVASATION DIE TO STUMULATION OF THE TRIGEMINAL GANGLIA; 5-HT 1F AGONISTS ELI LILLY AND COMPANY (US) 1998-09-29 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-5708187-A MIGRANE HEADACHES ELI LILLY AND COMPANY (US) 1998-01-13 US disclosed
EP-0749962-A1 6-substituted-1,2,3,4-tetrahydro-9H-carbazoles and 7-substituted-10H-cyclohepta(7,6-B)indoles ELI LILLY AND COMPANY (US) 1996-12-27 EP disclosed