SCHEMBL2876071

SCHEMBL2876071

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CC(Oc5ccc(C(=O)C=Cc6ccc(OCCCCCCBr)cc6)cc5)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 4/20 0.52
▸ POLA1 P09884 1/20 0.52
▸ FOLH1 Q04609 2/20 0.46
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ INPP5D Q92835 1/20 0.45
▸ HPSE Q9Y251 2/20 0.44
▸ ST6GAL1 P15907 1/20 0.43
▸ CD4 P01730 3/20 0.43
▸ VDR P11473 2/20 0.43
▸ USP2 O75604 1/20 0.43
▸ CCR1 P32246 1/20 0.42
▸ ABCC4 O15439 1/20 0.42

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
SCHEMBL2876066 1.00 CDC25A (0.52) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2878532 1.00 CDC25A (0.52) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2878530 1.00 CDC25A (0.52) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2876069 1.00 CDC25A (0.52) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2878531 1.00 CDC25A (0.52) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2873930 0.97 CDC25A (0.53) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2873926 0.97 CDC25A (0.53) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2876119 0.97 CDC25A (0.53) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2873927 0.97 CDC25A (0.53) CDC25APOLA1FOLH1CYP2D6CYP2C19
SCHEMBL2876121 0.97 CDC25A (0.53) CDC25APOLA1FOLH1CYP2D6CYP2C19

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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