SCHEMBL19854979

SCHEMBL19854979

C#C[C@H](CCCC(C)C)[C@H]1CC[C@H]2[C@@H]3CCC4C[C@@H](OC(=O)C(=C)COCCO)CC[C@]4(C)C3CC[C@]12C

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 4/20 0.53
▸ POLA1 P09884 1/20 0.53
▸ VDR P11473 3/20 0.48
▸ USP2 O75604 1/20 0.48
▸ ST6GAL1 P15907 1/20 0.45
▸ ABCC4 O15439 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43

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
SCHEMBL19722458 0.91 CDC25A (0.50) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL19722018 0.90 CDC25A (0.65) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL19722016 0.90 CDC25A (0.65) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL21298903 0.90 CDC25A (0.65) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL19854976 0.88 CDC25A (0.53) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL19721931 0.87 CDC25A (0.53) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL19854980 0.83 CDC25A (0.55) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL19855002 0.81 CDC25A (0.62) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL21298955 0.81 CDC25A (0.62) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL19755107 0.81 CDC25A (0.62) CDC25APOLA1VDRUSP2ST6GAL1

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-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 — — WO disclosed
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