SCHEMBL10863664

SCHEMBL10863664

C=CC(=O)OC1CC[C@@]2(C)C(CCC3C2CC[C@@]2(C)C3CC[C@@H]2[C@H](C)CCCC(C)C)C1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 4/20 0.72
▸ POLA1 P09884 1/20 0.71
▸ VDR P11473 3/20 0.62
▸ USP2 O75604 1/20 0.62
▸ CYP2D6 P10635 1/20 0.62
▸ CYP2C19 P33261 1/20 0.62
▸ INPP5D Q92835 1/20 0.61
▸ ST6GAL1 P15907 1/20 0.58
▸ FOLH1 Q04609 1/20 0.57
▸ ABCC4 O15439 1/20 0.56
▸ HPSE Q9Y251 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
SCHEMBL30495402 1.00 CDC25A (0.72) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL10625785 0.89 CDC25A (0.63) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL16425695 0.89 CDC25A (0.72) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL17123258 0.89 CDC25A (0.72) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL24403430 0.89 VDR (0.79) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL13214256 0.89 VDR (0.79) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL11371121 0.89 VDR (0.79) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL12205280 0.89 VDR (0.79) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL10052613 0.89 VDR (0.79) CDC25APOLA1VDRUSP2CYP2D6
SCHEMBL4739364 0.89 VDR (0.79) CDC25APOLA1VDRUSP2CYP2D6

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-4614619-A Liquid crystalline materials useful to prepare polymeric films ARMSTRONG WORLD INDUSTRIES, INC. (US) 1986-09-30 — — US disclosed
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