SCHEMBL5158495

SCHEMBL5158495

OCc1ccc(OCCC2CCCCN2)cc1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 15/20 0.52
SSTR2 P30874 2/20 0.48
CHEK2 O96017 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47

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
SCHEMBL4095536 0.93 LTA4H (0.51) LTA4HSSTR2HRH3
SCHEMBL7413290 0.89 LTA4H (0.50) LTA4HCHEK2HRH3
SCHEMBL7347261 0.86 LTA4H (0.54) LTA4HCHEK2
SCHEMBL2185418 0.85 LTA4H (0.50) LTA4HSSTR2CHEK2
SCHEMBL5104605 0.85 LTA4H (0.52) LTA4HCHEK2
SCHEMBL3647995 0.84 LTA4H (0.53) LTA4HCHEK2HRH3
Hydrochloric Acid SCHEMBL5159301 0.84 LTA4H (0.53) LTA4HCHEK2
SCHEMBL6005460 0.84 LTA4H (0.49) LTA4HSSTR2CHEK2
SCHEMBL13809106 0.83 LTA4H (0.76) LTA4H
SCHEMBL7326422 0.83 LTA4H (0.76) LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1777214-A2 Novel aryloxy-alkyl-dialkylamines Wyeth (US) 2007-04-25 EP disclosed
EP-1025077-B1 NOVEL ARYLOXY-ALKYL-DIALKYLAMINES WYETH CORP (US) 2007-02-28 EP disclosed
US-6268504-B1 USED IN THE PRODUCTION OF PHARMACEUTICAL PRODUCTS AMERICAN HOME PRODUCTS CORPORATION 2001-07-31 US disclosed
US-6242605-B1 Aryloxy-alkyl-dialkylamines AMERICAN HOME PRODUCTS CORPORATION 2001-06-05 US disclosed
EP-1025077-A1 NOVEL ARYLOXY-ALKYL-DIALKYLAMINES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-09 EP disclosed
US-6005102-A NOVEL INTERMEDIATES WHICH MAY BE USED IN THE PRODUCTION OF PHARMACEUTICAL COMPOUNDS FOR ANTI-ESTROGENIC AND MATRIX METALLOPROTEINASES-INHIBITING UTILITIES AMERICAN HOME PRODUCTS CORPORATION (US) 1999-12-21 US disclosed
WO-1999019293-A1 NOVEL ARYLOXY-ALKYL-DIALKYLAMINES AMERICAN HOME PRODUCTS CORPORATION (US) 1999-04-22 WO disclosed