SCHEMBL7915852

SCHEMBL7915852

FC(F)(F)c1cccc(OCCOc2ccc(CCCN3CCCC3)cc2)c1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.67
HRH3 Q9Y5N1 12/20 0.59
CACNA1B Q00975 3/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
HTT P42858 1/20 0.52
KMT2A Q03164 1/20 0.52
CACNA1H O95180 1/20 0.51

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
SCHEMBL11244902 0.82 LTA4H (0.81) LTA4HHRH3KDM4EALDH1A1LMNA
SCHEMBL14970473 0.82 LTA4H (0.81) LTA4HHRH3KDM4EALDH1A1LMNA
SCHEMBL7999188 0.82 HRH3 (0.75) LTA4HHRH3KDM4EALDH1A1
Hydrochloric Acid SCHEMBL14969107 0.81 LTA4H (0.79) LTA4HHRH3KDM4EALDH1A1LMNA
SCHEMBL8107620 0.80 HRH3 (0.75) LTA4HHRH3KDM4EALDH1A1
SCHEMBL16024760 0.80 SLC6A3 (0.66) LTA4HKDM4EALDH1A1GAAKMT2A
SCHEMBL13493035 0.80 KDM4E (0.74) LTA4HHRH3KDM4EALDH1A1
SCHEMBL19043551 0.79 HRH3 (0.69) LTA4HHRH3LMNAHTTKMT2A
SCHEMBL4177277 0.79 LTA4H (0.67) LTA4HHRH3KDM4EALDH1A1LMNA
SCHEMBL22813669 0.79 HRH3 (0.64) LTA4HHRH3CACNA1B

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 3 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-2010039256-A1 2-ACYLAMINOPROPOANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2010-04-08 WO disclosed
WO-2009117150-A2 METHOD OF TREATING LUPUS WITH CERAMIDE DERIVATIVES GENZYME CORPORATION (US) 2009-09-24 WO disclosed