SCHEMBL20797236

SCHEMBL20797236

CCCC1CC=C(c2ccc(B(O)O)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.48
LPL P06858 7/20 0.38
LIPG Q9Y5X9 7/20 0.38
CA2 P00918 4/20 0.36
CA1 P00915 3/20 0.36
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
RAB9A P51151 1/20 0.35
SENP8 Q96LD8 1/20 0.35
NLRP3 Q96P20 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
MGLL Q99685 2/20 0.34
TRPV1 Q8NER1 1/20 0.34
TSHR P16473 1/20 0.32
FLT3 P36888 1/20 0.31
TYRO3 Q06418 1/20 0.31
MERTK Q12866 1/20 0.31
GAS6 Q14393 1/20 0.31
BACE1 P56817 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
SCHEMBL11190434 0.87 ESR2 (0.54) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL11195824 0.86 ESR2 (0.53) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL8972749 0.83 ESR2 (0.69) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL11195873 0.83 ESR2 (0.50) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL8973205 0.82 ESR2 (0.67) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL10931485 0.81 ESR2 (0.49) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL11192882 0.81 ESR2 (0.49) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL2890308 0.81 ESR2 (0.49) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL11193083 0.81 ESR2 (0.49) ESR2NPC1CASP3RAB9ASENP8
SCHEMBL8932614 0.81 ESR2 (0.42) ESR2NPC1CASP3RAB9ASENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119120038-A Liquid crystal medium, liquid crystal display device containing same and compound 默克专利股份有限公司 2024-12-13 CN disclosed
CN-114144498-B Liquid crystal medium, liquid crystal display device containing same and compound 默克专利股份有限公司 2024-09-10 CN disclosed
CN-111094512-B Liquid crystal medium and liquid crystal display comprising same 默克专利股份有限公司 2024-01-09 CN disclosed
EP-3679111-B1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2023-11-01 EP disclosed
US-11795398-B2 Liquid-crystalline medium and liquid-crystal display comprising the same and compounds MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
US-11795398-B2 Liquid-crystalline medium and liquid-crystal display comprising the same and compounds MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
US-20220228065-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2022-07-21 US disclosed
US-11326102-B2 Liquid-crystalline medium and liquid-crystal display comprising the same MERCK PATENT GMBH (DE) 2022-05-10 US disclosed
US-11326102-B2 Liquid-crystalline medium and liquid-crystal display comprising the same MERCK PATENT GMBH (DE) 2022-05-10 US disclosed
CN-114144498-A Liquid crystal medium, liquid crystal display containing same and compound 默克专利股份有限公司 2022-03-04 CN disclosed
WO-2021004868-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME AND COMPOUNDS MERCK PATENT GMBH (DE) 2021-01-14 WO disclosed
US-20200385636-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2020-12-10 US disclosed
EP-3679111-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME Merck Patent GmbH (DE) 2020-07-15 EP disclosed
WO-2019048444-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2019-03-14 WO disclosed