SCHEMBL16351981

SCHEMBL16351981

Cc1ccc(-c2cc(C(=O)OCCOCc3ccccc3)cc(-c3ccc(OCc4ccccc4)cc3)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.51
MAOB P27338 2/20 0.46
MCL1 Q07820 3/20 0.46
PPARG P37231 2/20 0.45
PPARD Q03181 1/20 0.45
PTGER4 P35408 1/20 0.45
PTGER3 P43115 1/20 0.45
NR4A1 P22736 1/20 0.45
NR4A2 P43354 1/20 0.45
NR4A3 Q92570 1/20 0.45
DHODH Q02127 1/20 0.44
PARP10 Q53GL7 1/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PPARA Q07869 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SCN2A Q99250 1/20 0.43

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
SCHEMBL18500350 0.94 MCL1 (0.50) FFAR1MAOBMCL1PPARGPPARD
SCHEMBL16321322 0.92 MCL1 (0.48) FFAR1MAOBMCL1PPARGPPARD
SCHEMBL16320338 0.92 MCL1 (0.50) FFAR1MAOBMCL1PPARGPPARD
SCHEMBL16351942 0.91 L3MBTL1 (0.46) PPARGDHODHLMNAL3MBTL1PPARA
SCHEMBL16351984 0.90 NPC1 (0.46) FFAR1MAOBMCL1PPARGPPARD
SCHEMBL18500373 0.89 MCL1 (0.50) FFAR1MAOBMCL1PPARGPPARD
SCHEMBL16351980 0.87 NPC1 (0.47) PPARGLMNAL3MBTL1PPARAKMT2A
SCHEMBL16320799 0.87 MCL1 (0.52) FFAR1MAOBMCL1PTGER4PTGER3
SCHEMBL18625355 0.85 PTGER4 (0.56) FFAR1MAOBMCL1PPARGPPARD
SCHEMBL16320669 0.85 MCL1 (0.48) FFAR1MAOBMCL1PPARGPPARD

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-9567526-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-02-14 US disclosed
US-20140375943-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-12-25 US disclosed