SCHEMBL7658766

SCHEMBL7658766

CCNC1CCc2[nH]c3ccc(NC(=O)c4ccc(Cl)cc4Cl)cc3c2C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 1/20 0.46
HTR1A P08908 2/20 0.45
HTR1B P28222 2/20 0.45
HTR1D P28221 1/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
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
SIRT1 Q96EB6 1/20 0.42
HSD11B1 P28845 2/20 0.42

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
SCHEMBL7666034 0.91 HTR1F (0.53) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7663031 0.90 JAK2 (0.49) HTR1FHTR1AHTR1BHTR1DNPC1
SCHEMBL7655283 0.88 HTR1F (0.57) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7655587 0.86 JAK2 (0.51) HTR1FHTR1AHTR1BHTR1DNPC1
SCHEMBL7664604 0.85 JAK2 (0.50) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7658152 0.85 HTR1F (0.47) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7657003 0.84 HTR1F (0.48) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7659583 0.84 HTR1F (0.54) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL7656963 0.84 HTR1F (0.54) HTR1FHTR1AHTR1BHTR1DNPC1
SCHEMBL7658760 0.83 HTR1F (0.66) HTR1FNPC1RAB9ASIRT1HSD11B1

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