SCHEMBL7654336

SCHEMBL7654336

CN(C)C1CCc2[nH]c3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3c2C1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 1/20 0.68
MAPT P10636 15/20 0.50
LMNA P02545 13/20 0.50
THRB P10828 2/20 0.50
TP53 P04637 12/20 0.49
HTR6 P50406 3/20 0.48
HTR1A P08908 2/20 0.48
HTR2C P28335 2/20 0.48
HTR7 P34969 2/20 0.48
POLB P06746 2/20 0.46

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
SCHEMBL7665946 0.91 MAPT (0.58) HTR1FMAPTLMNATHRBTP53
SCHEMBL7661628 0.90 HTR1F (0.55) HTR1FMAPTLMNATHRBTP53
SCHEMBL7663563 0.90 HTR1F (0.55) HTR1FMAPTLMNATHRBTP53
SCHEMBL7653831 0.90 HTR1F (0.57) HTR1FMAPTLMNATHRBTP53
SCHEMBL7654341 0.83 MAPT (0.48) HTR1FMAPTLMNATHRBTP53
SCHEMBL8110900 0.81 HTR1F (1.00) HTR1FMAPTLMNATP53HTR1A
SCHEMBL7665368 0.81 HTR1F (1.00) HTR1FMAPTLMNATP53HTR1A
SCHEMBL7407128 0.81 HTR1F (0.67) HTR1FHTR6HTR1A
Hydrochloric Acid SCHEMBL30819314 0.80 HTR1F (0.98) HTR1FMAPTLMNAHTR1A
SCHEMBL6953187 0.80 MAPT (0.58) HTR1FMAPTTHRBTP53HTR6

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 9 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
WO-1998011895-A1 A METHOD FOR THE PREVENTION OF MIGRAINE ELI LILLY AND COMPANY (US) 1998-03-26 WO 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