SCHEMBL23177209

SCHEMBL23177209

C=C(CO)C(=O)OCCOc1cc(OCCOC(=O)C(C)(C)CO)cc(-c2ccc(C3CCCCC3)cc2)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.36
▸ PPARA Q07869 2/20 0.36
▸ CYP3A4 P08684 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NAAA Q02083 2/20 0.32
▸ ASAH1 Q13510 1/20 0.32
▸ APP P05067 1/20 0.32
▸ HRH3 Q9Y5N1 2/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ DGAT1 O75907 2/20 0.30
▸ LMNA P02545 1/20 0.30

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
SCHEMBL21675434 0.91 FFAR4 (0.38) PPARGPPARACYP3A4CYP2C9FFAR4
SCHEMBL20322630 0.87 CYP2C9 (0.36) PPARGPPARACYP2C9ALDH1A1MAPT
SCHEMBL20322738 0.87 RAB9A (0.33) PPARGPPARACYP2C9ALDH1A1MAPT
SCHEMBL20322673 0.87 RAB9A (0.33) PPARGPPARACYP2C9ALDH1A1MAPT
SCHEMBL20322938 0.84 CYP2C9 (0.35) CYP2C9FFAR4ALDH1A1MAPTLMNA
SCHEMBL22101097 0.83 HRH3 (0.35) FFAR4HRH3
SCHEMBL20313557 0.81 CYP2C9 (0.43) PPARGPPARACYP2C9ALDH1A1MAPT
SCHEMBL20322699 0.81 MMP2 (0.36) PPARGPPARA
SCHEMBL20322680 0.81 FFAR4 (0.32) FFAR4
SCHEMBL23635468 0.81 RAB9A (0.39) PPARGPPARACYP2C9ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230007940-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCKP PATENT GMBH (DE) 2023-01-12 — — US disclosed
US-11353751-B2 Double layer liquid crystal device and process of manufacture MERCK PATENT GMBH (DE) 2022-06-07 — — US disclosed
US-20210096431-A1 Double Layer Liquid Crystal Device and Process of Manufacture MERCK PATENT GMBH (DE) 2021-04-01 — — US disclosed
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