SCHEMBL3015938

SCHEMBL3015938

CCCCCCCCCCCCCCOC[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OCCCCCCCCCCCCCC

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 1/20 0.53
▸ MAPK1 P28482 1/20 0.47
▸ SELP P16109 3/20 0.44
▸ SELL P14151 2/20 0.44
▸ SELE P16581 2/20 0.44

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
SCHEMBL10782436 1.00 CETP (0.53) CETPMAPK1SELPSELLSELE
SCHEMBL19874824 1.00 CETP (0.53) CETPMAPK1SELPSELLSELE
SCHEMBL18786584 0.99 CETP (0.51) CETPMAPK1SELPSELLSELE
SCHEMBL17782908 0.99 CETP (0.51) CETPMAPK1SELPSELLSELE
SCHEMBL17008954 0.99 CETP (0.51) CETPMAPK1SELPSELLSELE
SCHEMBL1840886 0.99 CETP (0.51) CETPMAPK1SELPSELLSELE
SCHEMBL1614746 0.99 CETP (0.51) CETPMAPK1SELPSELLSELE
SCHEMBL15477780 0.99 CETP (0.51) CETPMAPK1SELPSELLSELE
SCHEMBL9701069 0.96 CETP (0.56) CETPMAPK1SELPSELLSELE
SCHEMBL7133066 0.94 CETP (0.47) CETPMAPK1

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
US-20100197018-A1 USE OF SUBSTRATES AS PHARMACOLOGICAL CHAPERONES AMICUS THERAPEUTICS, INC. (US) 2010-08-05 — — US claimed
EP-2137204-A1 USE OF SUBSTRATES AS PHARMACOLOGICAL CHAPERONES Amicus Therapeutics, Inc. (US) 2009-12-30 — — EP claimed
WO-2008128089-A1 USE OF SUBSTRATES AS PHARMACOLOGICAL CHAPERONES AMICUS THERAPEUTICS, INC. (US) 2008-10-23 — — WO claimed
US-10760112-B2 Enzymatic activity assays for glucocerebrosidase SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2020-09-01 — — US disclosed
US-20180051315-A1 ENZYMATIC ACTIVITY ASSAYS FOR GLUCOCEREBROSIDASE SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2018-02-22 — — US disclosed
US-20100197018-A1 USE OF SUBSTRATES AS PHARMACOLOGICAL CHAPERONES AMICUS THERAPEUTICS, INC. (US) 2010-08-05 — — US disclosed
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