SCHEMBL1880277

SCHEMBL1880277

CC(C)(C)CCCCCCCCCCCC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.43
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC8 Q9BY41 2/20 0.38
DGKA P23743 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 1/20 0.34
FFAR1 O14842 1/20 0.34
CPT2 P23786 1/20 0.34
LMNA P02545 3/20 0.34
PAM P19021 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HDAC3 O15379 1/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
RECQL P46063 1/20 0.32
STING1 Q86WV6 1/20 0.32

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
SCHEMBL10250201 1.00 EPHX2 (0.43) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL25557803 1.00 EPHX2 (0.43) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL3689198 1.00 EPHX2 (0.43) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL28710679 1.00 EPHX2 (0.43) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL16863814 1.00 EPHX2 (0.43) EPHX2HDAC1HDAC2HDAC6HDAC8
Water SCHEMBL28067332 0.98 EPHX2 (0.42) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL22869218 0.98 EPHX2 (0.41) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL28274472 0.92 EPHX2 (0.38) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL12775715 0.91 EPHX2 (0.39) EPHX2HDAC1HDAC2HDAC6HDAC8
SCHEMBL27531834 0.91 EPHX2 (0.39) EPHX2HDAC1HDAC2HDAC6HDAC8

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-7937023-B2 Method and a composition for producing an undercoat layer using dialkyl malonate blocked isocyanates (for electrophotographic applications) EASTMAN KODAK COMPANY (US) 2011-05-03 US disclosed
US-20060009576-A1 Method and a composition for producing an undercoat layer using dialkyl malonate blocked isocyanates (for electrophotographic applications) EASTMAN KODAK COMPANY 2006-01-12 US disclosed