SCHEMBL3513779

SCHEMBL3513779

CC(C)C(C(=O)O)=C(C(=O)O)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
RECQL P46063 2/20 0.34
EPHX1 P07099 3/20 0.33
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 3/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL10193617 1.00 CES2 (0.39) CES2CES1HDAC8HDAC6RECQL
SCHEMBL3513774 1.00 CES2 (0.39) CES2CES1HDAC8HDAC6RECQL
SCHEMBL304662 0.98 CES2 (0.38) CES2CES1HDAC8HDAC6RECQL
SCHEMBL304664 0.98 CES2 (0.38) CES2CES1HDAC8HDAC6RECQL
SCHEMBL10193609 0.98 CES2 (0.36) CES2CES1HDAC8HDAC6RECQL
SCHEMBL3513963 0.98 CES2 (0.36) CES2CES1HDAC8HDAC6RECQL
SCHEMBL3513968 0.98 CES2 (0.36) CES2CES1HDAC8HDAC6RECQL
SCHEMBL304243 0.96 CES2 (0.34) CES2CES1HDAC8HDAC6RECQL
SCHEMBL304245 0.96 CES2 (0.34) CES2CES1HDAC8HDAC6RECQL
SCHEMBL15928691 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0244835-B1 LANGMUIR-BLODGETT ULTRATHIN MEMBRANE OF POLYFUMURATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-08-26 EP claimed
EP-0233299-B1 OPTICAL RESIN AND PROCESS FOR PREPARING THE SAME NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-03-13 EP claimed
US-8236917-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2012-08-07 US disclosed
US-20100240855-A1 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2010-09-23 US disclosed