SCHEMBL7656208

SCHEMBL7656208

c1ccc(CCNC2CCc3[nH]c4ccc(OCc5ccccc5)cc4c3C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.53
IGF1R P08069 1/20 0.53
FLT4 P35916 1/20 0.53
KDR P35968 1/20 0.53
MAPKAPK2 P49137 1/20 0.49
ADRA1A P35348 1/20 0.47
HTR1D P28221 3/20 0.47
HTR1B P28222 3/20 0.47
RB1 P06400 2/20 0.46
GRIN2B Q13224 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
SCHEMBL7655690 0.94 EGFR (0.53) EGFRIGF1RFLT4KDRMAPKAPK2
SCHEMBL7657062 0.94 EGFR (0.51) EGFRIGF1RFLT4KDRMAPKAPK2
Hydrochloric Acid SCHEMBL7654439 0.94 EGFR (0.52) EGFRIGF1RFLT4KDRMAPKAPK2
Hydrochloric Acid SCHEMBL8606288 0.92 EGFR (0.51) EGFRIGF1RFLT4KDRMAPKAPK2
SCHEMBL7654350 0.91 HTR1D (0.51) EGFRIGF1RFLT4KDRMAPKAPK2
SCHEMBL7655639 0.89 HTR1D (0.50) EGFRIGF1RFLT4KDRMAPKAPK2
SCHEMBL7661161 0.89 EGFR (0.43) EGFRIGF1RFLT4KDRMAPKAPK2
SCHEMBL7662787 0.87 HTR1B (0.53) EGFRIGF1RFLT4KDRMAPKAPK2
SCHEMBL7660070 0.87 EGFR (0.42) EGFRIGF1RFLT4KDRMAPKAPK2
SCHEMBL7663796 0.85 HTR2A (0.51) EGFRIGF1RFLT4KDRHTR1D

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