SCHEMBL18699653

SCHEMBL18699653

C=C(C)C(=O)Oc1ccc(-c2ccc(OC)cc2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.47
BACE1 P56817 1/20 0.47
FFAR1 O14842 3/20 0.45
PPARD Q03181 1/20 0.45
MAPT P10636 2/20 0.44
DHODH Q02127 1/20 0.42
NAAA Q02083 2/20 0.41
ERN1 O75460 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
APP P05067 1/20 0.39
CYP2C19 P33261 1/20 0.39
ELANE P08246 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
CASP3 P42574 1/20 0.39

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
SCHEMBL20312074 0.91 ERN1 (0.48) FFAR1MAPTNAAAERN1MAPK1
SCHEMBL9607907 0.91 ELANE (0.48) ABCB1BACE1FFAR1PPARDMAPT
SCHEMBL19824549 0.91 ELANE (0.48) ABCB1BACE1FFAR1PPARDMAPT
SCHEMBL17433322 0.91 CFD (0.41) ABCB1FFAR1MAPTERN1CYP2C19
SCHEMBL25944784 0.90 ELANE (0.41) ABCB1BACE1FFAR1PPARDMAPT
SCHEMBL21469933 0.90 ERN1 (0.45) ABCB1FFAR1MAPTNAAAERN1
SCHEMBL18435890 0.90 ERN1 (0.45) ABCB1FFAR1MAPTNAAAERN1
SCHEMBL18869421 0.90 ERN1 (0.49) FFAR1NAAAERN1NPC1MAPK1
SCHEMBL9607788 0.89 CFD (0.42) FFAR1MAPTERN1ELANEMAPK1
SCHEMBL18308841 0.87 ERN1 (0.47) ABCB1FFAR1MAPTERN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3489329-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2022-01-12 EP disclosed
EP-3587536-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2021-03-24 EP disclosed
EP-3235894-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-12-23 EP disclosed
WO-2020230480-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT, AND COMPOUND DIC株式会社 2020-11-19 WO disclosed
EP-3502209-B1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2020-10-14 EP disclosed
EP-3677659-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2020-07-08 EP disclosed
WO-2020137574-A1 LIQUID CRYSTAL DISPLAY ELEMENT DIC株式会社 2020-07-02 WO disclosed
EP-3428246-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-04-15 EP disclosed
EP-3119854-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2020-02-05 EP disclosed
EP-3048159-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2019-08-07 EP disclosed
EP-3502209-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT Merck Patent GmbH (DE) 2019-06-26 EP disclosed
EP-3489329-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2019-05-29 EP disclosed
EP-3067406-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-04-24 EP disclosed
EP-3067405-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-03-27 EP disclosed
EP-3428246-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2019-01-16 EP disclosed
EP-3421569-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2019-01-02 EP disclosed
EP-3351525-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2018-07-25 EP disclosed
EP-3235894-A2 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2017-10-25 EP disclosed
EP-2937401-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-04-05 EP disclosed