SCHEMBL2880675

SCHEMBL2880675

CC(C)CCC[C@@H](C)[C@H]1CCC2C3CCC4CC(OC(=O)C=Cc5ccc(OCCBr)cc5)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 4/20 0.56
▸ POLA1 P09884 1/20 0.56
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ USP2 O75604 1/20 0.49
▸ VDR P11473 1/20 0.49
▸ INPP5D Q92835 1/20 0.49
▸ FOLH1 Q04609 2/20 0.47
▸ ST6GAL1 P15907 1/20 0.47
▸ HPSE Q9Y251 1/20 0.46

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
SCHEMBL2878393 0.96 CDC25A (0.55) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2873926 0.89 CDC25A (0.53) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2876121 0.89 CDC25A (0.53) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2873930 0.89 CDC25A (0.53) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2876119 0.89 CDC25A (0.53) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2873927 0.89 CDC25A (0.53) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2878791 0.89 CDC25A (0.56) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL9616054 0.88 CDC25A (0.68) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2878530 0.86 CDC25A (0.52) CDC25APOLA1CYP2D6CYP2C19USP2
SCHEMBL2876066 0.86 CDC25A (0.52) CDC25APOLA1CYP2D6CYP2C19USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1818354-B1 Liquid crystal aligning agent, alignment film and liquid crystal display device JSR CORP (JP) 2010-10-20 — — EP disclosed
EP-1818354-A2 Liquid crystal aligning agent, alignment film and liquid crystal display device JSR Corporation (JP) 2007-08-15 — — EP disclosed
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