SCHEMBL7995012

SCHEMBL7995012

c1ccc(COc2ccc(CCCN3CCCC3)cc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.83
LTA4H P09960 3/20 0.71
HTT P42858 3/20 0.71
KMT2A Q03164 1/20 0.71
NPC1 O15118 3/20 0.69
RAB9A P51151 3/20 0.69
KDM4E B2RXH2 3/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
ALDH1A1 P00352 2/20 0.67
NPSR1 Q6W5P4 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
NPY1R P25929 1/20 0.66
SIGMAR1 Q99720 3/20 0.62

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
SCHEMBL7808301 0.91 HRH3 (0.69) HRH3LTA4HHTTKMT2ANPC1
SCHEMBL4689454 0.88 KDM4E (0.86) HRH3LTA4HHTTNPC1RAB9A
SCHEMBL7999188 0.87 HRH3 (0.75) HRH3LTA4HKDM4ESMN1; SMN2ALDH1A1
SCHEMBL3581020 0.87 NPC1 (0.87) HRH3LTA4HHTTNPC1RAB9A
SCHEMBL8107620 0.87 HRH3 (0.75) HRH3LTA4HKDM4ESMN1; SMN2ALDH1A1
SCHEMBL14970586 0.87 NPC1 (0.87) HRH3LTA4HHTTNPC1RAB9A
SCHEMBL7402238 0.85 KDM4E (0.85) HRH3LTA4HHTTKMT2ANPC1
SCHEMBL20382580 0.84 LTA4H (0.86) HRH3LTA4HSIGMAR1
Hydrochloric Acid SCHEMBL7397479 0.84 KDM4E (0.82) HRH3LTA4HHTTKMT2ANPC1
SCHEMBL7402377 0.84 KDM4E (0.85) HRH3LTA4HHTTNPC1RAB9A

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
EP-2594563-B1 2-acylaminopropanol-type glucosylceramide synthase inhibitors GENZYME CORP (US) 2018-07-18 EP disclosed
EP-2320886-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITION FOR THE TREATMENT OF COLLAPSING GLOMERULOPATHY AND OTHER GLOMERULAR DISEASE GENZYME CORP (US) 2017-06-28 EP disclosed
EP-2594564-A2 2-acylaminopropanol-type glucosylceramide synthase inhibitors Genzyme Corporation (US) 2013-05-22 EP disclosed
EP-2594562-A2 2-acylaminopropanol-type glucosylceramide synthase inhibitors Genzyme Corporation (US) 2013-05-22 EP disclosed
EP-2594563-A2 2-acylaminopropanol-type glucosylceramide synthase inhibitors Genzyme Corporation (US) 2013-05-22 EP disclosed
EP-2594565-A2 2-acylaminopropanol-type glucosylceramide synthase inhibitors Genzyme Corporation (US) 2013-05-22 EP disclosed
WO-2009117150-A2 METHOD OF TREATING LUPUS WITH CERAMIDE DERIVATIVES GENZYME CORPORATION (US) 2009-09-24 WO disclosed
WO-2008150486-A2 2-ACYLAMINOPROPOANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2008-12-11 WO disclosed