SCHEMBL4965391

SCHEMBL4965391

c1ccc(OCCC2CCCCN2)cc1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 11/20 0.64
POLB P06746 1/20 0.54
KMT2A Q03164 1/20 0.51
SLC6A2 P23975 1/20 0.46
HRH2 P25021 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2B P41595 1/20 0.46
SLC6A3 Q01959 1/20 0.46
SIGMAR1 Q99720 1/20 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
SCHEMBL6610063 0.95 LTA4H (0.57) LTA4HSLC6A2HRH2HTR2AHTR2B
SCHEMBL7335832 0.94 LTA4H (0.74) LTA4HPOLB
Hydrochloric Acid SCHEMBL7334091 0.93 LTA4H (0.72) LTA4HPOLBKMT2A
SCHEMBL6611442 0.92 LTA4H (0.62) LTA4HPOLBKMT2A
SCHEMBL13809106 0.89 LTA4H (0.76) LTA4HPOLB
SCHEMBL7326422 0.89 LTA4H (0.76) LTA4HPOLB
SCHEMBL7327575 0.89 LTA4H (0.60) LTA4HPOLBKMT2AHTR2B
SCHEMBL14578215 0.88 CHRNB4 (0.52) LTA4HPOLB
Hydrochloric Acid SCHEMBL4319150 0.87 LTA4H (0.74) LTA4HPOLB
Hydrochloric Acid SCHEMBL7323937 0.87 LTA4H (0.74) LTA4HPOLB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1891051-A2 SOLID FORMS OF 1-( 5-(IH-I , 2 , 4 -TRIAZOL- 5 -YL)(1H-INDAZOL-3-YL))-3-(2-PIPERIDYLETHOXY)BENZENE CELGENE CORPORATION (US) 2008-02-27 EP disclosed
WO-2006130297-A2 SOLID FORMS OF 1-( 5-(IH-I , 2 , 4 -TRIAZOL- 5 -YL)(1H-INDAZOL-3-YL))-3-(2-PIPERIDYLETHOXY)BENZENE CELGENE CORPORATION (US) 2006-12-07 WO disclosed
EP-1435955-A2 N-AROYL CYCLIC AMINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS SmithKline Beecham P.L.C. (GB) 2004-07-14 EP disclosed
WO-2002089800-A2 N-AROYL CYCLIC AMINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM P.L.C. (GB) 2002-11-14 WO disclosed
US-4225608-A ANTIDEPRESSANTS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-09-30 US disclosed
EP-0004288-A2 Phenoxyalkyl amines, pharmaceutical compositions containing them, and process for their preparation MERCK PATENT GmbH (DE) 1979-10-03 EP disclosed