SCHEMBL10299716

SCHEMBL10299716

CC(C)CCCC(C)C1CCC2C3CCC4CC(Oc5ccc6c(c5)C(=O)OC6=O)CCC4(C)C3CCC12C

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 4/20 0.57
POLA1 P09884 1/20 0.57
CYP2D6 P10635 1/20 0.54
CYP2C19 P33261 1/20 0.54
INPP5D Q92835 1/20 0.53
ST6GAL1 P15907 1/20 0.49
HPSE Q9Y251 9/20 0.48
FGF1 P05230 7/20 0.48
FOLH1 Q04609 1/20 0.48
FGF2 P09038 6/20 0.47

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
SCHEMBL17425887 0.91 CDC25A (0.59) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL10298004 0.86 CDC25A (0.71) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL17828416 0.83 CDC25A (0.48) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL2608110 0.82 CDC25A (0.47) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL29199051 0.82 CYP2D6 (0.64) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL105206 0.82 CYP2D6 (0.64) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL29199047 0.82 CYP2D6 (0.64) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL15939991 0.82 CYP2D6 (0.64) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL9193327 0.82 CDC25A (0.57) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL8906578 0.82 CDC25A (0.57) CDC25APOLA1CYP2D6CYP2C19INPP5D

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
US-8216649-B2 Liquid crystal aligning agent, method of producing a liquid crystal alignment film and liquid crystal display device JSR CORPORATION (JP) 2012-07-10 US disclosed
US-20110068301-A1 LIQUID CRYSTAL ALIGNING AGENT, METHOD OF PRODUCING A LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORPORATION (JP) 2011-03-24 US disclosed