SCHEMBL7999523

SCHEMBL7999523

OCCCOc1ccc(CCCN2CCCC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 19/20 0.78
ACHE P22303 1/20 0.61
RAD52 P43351 1/20 0.61
LTA4H P09960 1/20 0.60

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
SCHEMBL2821540 0.93 HRH3 (0.86) HRH3ACHERAD52
SCHEMBL2823878 0.91 HRH3 (0.84) HRH3ACHERAD52
SCHEMBL2820804 0.90 HRH3 (0.82) HRH3ACHERAD52
SCHEMBL12061359 0.88 HRH3 (1.00) HRH3ACHERAD52
SCHEMBL2823988 0.88 HRH3 (1.00) HRH3ACHERAD52
SCHEMBL4662212 0.88 HRH3 (0.78) HRH3ACHERAD52
SCHEMBL19043080 0.86 HRH3 (0.77) HRH3ACHERAD52LTA4H
SCHEMBL12050749 0.85 HRH3 (1.00) HRH3ACHERAD52
SCHEMBL8107620 0.85 HRH3 (0.75) HRH3LTA4H
SCHEMBL7999188 0.85 HRH3 (0.75) HRH3LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2320886-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITION FOR THE TREATMENT OF COLLAPSING GLOMERULOPATHY AND OTHER GLOMERULAR DISEASE GENZYME CORP (US) 2017-06-28 EP disclosed
WO-2009117150-A2 METHOD OF TREATING LUPUS WITH CERAMIDE DERIVATIVES GENZYME CORPORATION (US) 2009-09-24 WO disclosed