SCHEMBL16351935

SCHEMBL16351935

C=C(C)C(=O)OCCOC(=O)c1ccc(-c2ccc(-c3ccc(OC(=O)C(=C)C)c(OC(=O)C(=C)C)c3)cc2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ THRB P10828 1/20 0.38
▸ PKM P14618 1/20 0.37
▸ RARB P10826 3/20 0.37
▸ RARA P10276 2/20 0.37
▸ RARG P13631 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ NAAA Q02083 2/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ USP2 O75604 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ SERPINE1 P05121 1/20 0.33
▸ FFAR1 O14842 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
SCHEMBL16351918 0.94 THRB (0.38) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16362185 0.93 NPC1 (0.44) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16351868 0.93 THRB (0.39) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL18500363 0.92 THRB (0.36) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16351914 0.90 THRB (0.45) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16351867 0.90 NPC1 (0.39) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16351866 0.89 RARB (0.42) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16351892 0.89 THRB (0.38) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16351927 0.88 THRB (0.38) NPC1L3MBTL1MEN1KMT2AATM
SCHEMBL16351928 0.87 RARB (0.38) NPC1L3MBTL1MEN1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2818531-B1 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-07-26 — — EP disclosed
US-9567526-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-02-14 — — US disclosed
US-9567526-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-02-14 — — US disclosed
EP-2818531-A1 Polymerisable compounds and the use thereof in liquid-crystal displays Merck Patent GmbH (DE) 2014-12-31 — — EP disclosed
US-20140375943-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-12-25 — — US disclosed
US-20140375943-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-12-25 — — US disclosed
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