SCHEMBL4735308

SCHEMBL4735308

COC1CC[C@@]2(C)C(CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CC[C@H](C)C(C)C)[C@@]4(C)CC[C@@H]32)C1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 4/20 0.58
▸ USP2 O75604 1/20 0.58
▸ CDC25A P30304 2/20 0.57
▸ ABCC4 O15439 1/20 0.56
▸ POLA1 P09884 1/20 0.56
▸ ST6GAL1 P15907 2/20 0.56
▸ GPBAR1 Q8TDU6 2/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ CYP2D6 P10635 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ INPP5D Q92835 1/20 0.53
▸ GRIN1 Q05586 1/20 0.53
▸ GRIN2B Q13224 1/20 0.53

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
SCHEMBL4739495 0.90 VDR (0.57) VDRUSP2CDC25AABCC4POLA1
SCHEMBL21928679 0.90 VDR (0.60) VDRUSP2CDC25AABCC4POLA1
SCHEMBL4739235 0.90 CDC25A (0.61) VDRUSP2CDC25AABCC4POLA1
SCHEMBL23282984 0.89 VDR (0.59) VDRUSP2CDC25AABCC4POLA1
SCHEMBL23282983 0.89 VDR (0.59) VDRUSP2CDC25AABCC4POLA1
SCHEMBL4739418 0.88 CDC25A (0.61) VDRUSP2CDC25AABCC4POLA1
SCHEMBL4740584 0.88 VDR (0.56) VDRUSP2CDC25AABCC4POLA1
SCHEMBL13017807 0.88 VDR (0.56) VDRUSP2CDC25AABCC4POLA1
SCHEMBL4740075 0.88 VDR (0.56) VDRUSP2CDC25AABCC4POLA1
SCHEMBL23282982 0.87 VDR (0.57) VDRUSP2CDC25AABCC4POLA1

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
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