SCHEMBL7925110

SCHEMBL7925110

c1ccc(-c2ccc(CCCN3CCCC3)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.75
▸ SIGMAR1 Q99720 7/20 0.69
▸ HRH3 Q9Y5N1 8/20 0.65
▸ SLC6A3 Q01959 1/20 0.61
▸ HRH1 P35367 1/20 0.59
▸ GRIN2B Q13224 1/20 0.59
▸ KCNH2 Q12809 1/20 0.59
▸ POLB P06746 1/20 0.57

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
SCHEMBL20382580 0.89 LTA4H (0.86) LTA4HSIGMAR1HRH3SLC6A3GRIN2B
SCHEMBL5302082 0.89 LTA4H (0.86) LTA4HSIGMAR1HRH3SLC6A3GRIN2B
SCHEMBL7366528 0.87 HRH3 (0.85) LTA4HSIGMAR1HRH3SLC6A3HRH1
SCHEMBL83687 0.87 SIGMAR1 (0.86) LTA4HSIGMAR1HRH3SLC6A3GRIN2B
SCHEMBL18917604 0.87 LTA4H (0.75) LTA4HSIGMAR1HRH3SLC6A3HRH1
Hydrochloric Acid SCHEMBL8037018 0.85 SIGMAR1 (0.83) LTA4HSIGMAR1HRH3SLC6A3GRIN2B
Hydrochloric Acid SCHEMBL7239522 0.85 LTA4H (0.80) LTA4HSIGMAR1HRH3SLC6A3GRIN2B
Ammonia Solution, Strong SCHEMBL28704893 0.85 SIGMAR1 (0.83) LTA4HSIGMAR1HRH3SLC6A3GRIN2B
Hydrochloric Acid SCHEMBL11155637 0.85 LTA4H (0.69) LTA4HSIGMAR1HRH3SLC6A3GRIN2B
SCHEMBL20797123 0.85 SIGMAR1 (0.81) LTA4HSIGMAR1HRH3POLB

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 6 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-3078373-A1 2-ACYLAMINOPROPANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITOR Genzyme Corporation (US) 2016-10-12 — — EP disclosed
WO-2010039256-A1 2-ACYLAMINOPROPOANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2010-04-08 — — WO 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-2008150486-A2 2-ACYLAMINOPROPOANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2008-12-11 — — WO disclosed
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