SCHEMBL7995727

SCHEMBL7995727

Cc1ccc([C@@H](O)CCN2CCCC2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 1/20 0.43
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
HTR1A P08908 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 2/20 0.41

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
SCHEMBL24045407 0.82 HTR1A (0.51) LMNAMEN1KMT2AHTTSLC6A4
SCHEMBL17937298 0.80 SLC6A4 (0.40) SLC6A4SLC6A3HTR1A
SCHEMBL7357631 0.79 HTR1A (0.62) SLC6A4SLC6A3HTR1A
SCHEMBL7998697 0.78 HTR1A (0.52) SMN1; SMN2MEN1KMT2AHTTSLC6A4
SCHEMBL16596083 0.77 GRIN2B (0.45) MEN1KMT2ASLC6A4SLC6A3
SCHEMBL21122987 0.77 GRIN2B (0.45) MEN1KMT2ASLC6A4SLC6A3
SCHEMBL7985198 0.76 MAPT (0.50) ALDH1A1LMNAMEN1KMT2AHTR1A
SCHEMBL18069816 0.74 GRIN2B (0.45) MEN1KMT2ASLC6A4SLC6A3
SCHEMBL7983037 0.73 GRIN2B (0.61) SLC6A4SLC6A3HTR1A
SCHEMBL20202580 0.73 LMNA (0.45) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2594564-B1 2-acylaminopropanol-type glucosylceramide synthase inhibitors GENZYME CORP (US) 2016-09-28 EP disclosed
EP-2594562-B1 2-acylaminopropanol-type glucosylceramide synthase inhibitors GENZYME CORP (US) 2016-07-20 EP disclosed
WO-2010014554-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITION FOR THE TREATMENT OF COLLAPSING GLOMERULOPATHY AND OTHER GLOMERULAR DISEASE GENZYME CORPORATION (US) 2010-02-04 WO 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