SCHEMBL17339704

SCHEMBL17339704

O=C(COC1(CCc2ccc([C@@H]3[C@@H](CC[C@H](O)c4ccc(F)cc4)C(=O)N3c3ccc(F)cc3)cc2)COC1)NC(CO)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1L1 Q9UHC9 8/20 0.51
CNR1 P21554 2/20 0.51
ABCB11 O95342 1/20 0.51
LMNA P02545 1/20 0.51
PGR P06401 1/20 0.51
CYP3A4 P08684 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
CHRM1 P11229 1/20 0.51
DRD1 P21728 1/20 0.51
TBXA2R P21731 1/20 0.51
PTGS1 P23219 1/20 0.51
SLC6A2 P23975 1/20 0.51
ADRA1A P35348 1/20 0.51
OPRM1 P35372 1/20 0.51
SLC6A3 Q01959 1/20 0.51
KCNH2 Q12809 1/20 0.51
SLC10A1 Q14973 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
CNR2 P34972 1/20 0.33
SOAT1 P35610 1/20 0.32

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
SCHEMBL456222 1.00 NPC1L1 (0.51) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL456221 1.00 NPC1L1 (0.51) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL469326 1.00 NPC1L1 (0.51) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL17339709 0.94 NPC1L1 (0.50) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL10070625 0.94 NPC1L1 (0.50) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL454686 0.94 NPC1L1 (0.50) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL454685 0.94 NPC1L1 (0.50) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL455145 0.93 NPC1L1 (0.49) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL469324 0.93 NPC1L1 (0.49) NPC1L1CNR1ABCB11LMNAPGR
SCHEMBL455144 0.93 NPC1L1 (0.49) NPC1L1CNR1ABCB11LMNAPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9212175-B2 Pharmaceutical hypocholesterolemic compositions LIPIDEON BIOTECHNOLOGY AG (CH) 2015-12-15 US disclosed