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SCHEMBL4739600

SCHEMBL4739600

CCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CC[C@H](C)C(C)C)CC[C@@H]32)C1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 3/20 0.62
▸ USP2 O75604 1/20 0.62
▸ ST6GAL1 P15907 1/20 0.58
▸ CDC25A P30304 2/20 0.56
▸ ABCC4 O15439 1/20 0.56
▸ POLA1 P09884 1/20 0.56

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
SCHEMBL4739601 1.00 VDR (0.62) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL4737102 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL1170137 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL4737999 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL4737997 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL1170070 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL4739222 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL4735816 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL4738675 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4
SCHEMBL4739225 0.99 VDR (0.61) VDRUSP2ST6GAL1CDC25AABCC4

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
WO-2008077247-A1 COATINGS FOR IMPLANTABLE MEDICAL DEVICES COMPRISING CHOLESTEROL MIV THERAPEUTICS INC. (CA) 2008-07-03 — — WO disclosed