SCHEMBL10299690

SCHEMBL10299690

CC(C)CCCC(C)C1CCC2C3CCC4CC(c5ccc(OCOc6ccc7c(c6)C(=O)OC7=O)cc5)(c5ccc(C(OO)c6ccc7c(c6)C(=O)OC7=O)cc5)CCC4(C)C3CCC12C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 4/20 0.42
POLA1 P09884 1/20 0.40
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
INPP5D Q92835 1/20 0.39
SRD5A1 P18405 4/20 0.38
CD4 P01730 4/20 0.38
SRD5A2 P31213 3/20 0.38
NPC1L1 Q9UHC9 2/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
CCR1 P32246 1/20 0.37
HPSE Q9Y251 2/20 0.35

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
SCHEMBL12607348 0.93 CDC25A (0.46) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL2608109 0.91 CDC25A (0.47) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL2622079 0.90 CDC25A (0.44) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL15682137 0.90 CDC25A (0.41) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL10054706 0.89 CDC25A (0.40) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL10299692 0.88 FNTA (0.39) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL11994882 0.86 CDC25A (0.39) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL2608110 0.86 CDC25A (0.47) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL10017576 0.84 CDC25A (0.45) CDC25APOLA1FNTAFNTBCYP2D6
SCHEMBL16640682 0.83 CYP2D6 (0.47) CDC25APOLA1FNTAFNTBCYP2D6

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