SCHEMBL3084046

SCHEMBL3084046

CCC(C)Cc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.56
ALDH1A1 P00352 2/20 0.53
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
MAPT P10636 2/20 0.53
MEN1 O00255 1/20 0.53
RARA P10276 1/20 0.53
MTOR P42345 1/20 0.53
KMT2A Q03164 1/20 0.53
ADRB1 P08588 4/20 0.52
ADRB3 P13945 4/20 0.52
BCL2 P10415 1/20 0.49
ANPEP P15144 1/20 0.47
ENPEP Q07075 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ACACB O00763 1/20 0.46

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
SCHEMBL9335694 1.00 RARB (0.56) RARBALDH1A1RXRARXRBMAPT
SCHEMBL4577544 0.95 ALDH1A1 (0.59) RARBALDH1A1RXRARXRBMAPT
SCHEMBL9234376 0.95 ALDH1A1 (0.59) RARBALDH1A1RXRARXRBMAPT
Hydrochloric Acid SCHEMBL9192168 0.93 ALDH1A1 (0.57) RARBALDH1A1RXRARXRBMAPT
SCHEMBL11654567 0.87 RARB (0.57) RARBALDH1A1RXRARXRBMAPT
SCHEMBL11219236 0.87 FOLH1 (0.46) RARBALDH1A1RXRARXRBMAPT
SCHEMBL19870480 0.86 KMT2A (0.50) RARBALDH1A1MAPTMEN1KMT2A
SCHEMBL13792664 0.86 KMT2A (0.50) RARBALDH1A1MAPTMEN1KMT2A
SCHEMBL11105339 0.85 RARB (0.39) RARBALDH1A1RXRARXRBMAPT
SCHEMBL9146322 0.85 RARB (0.39) RARBALDH1A1RXRARXRBMAPT

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1540414-A1 OPTICAL PATH SWITCHING DEVICE AND METHOD National Institute of Advanced Industrial Science and Technology (JP) 2005-06-15 EP claimed
WO-2004027508-A1 OPTICAL PATH SWITCHING DEVICE AND METHOD NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2004-04-01 WO claimed
EP-0035155-B1 TRANS-4\"-ALKYLCYCLOHEXYL ESTERS OF 4'-(2-METHYLBUTYL)-4-BIPHENYLCARBOXYLIC ACID AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME Chisso Corporation (JP) 1983-11-23 EP claimed
US-4341653-A Liquid-crystalline 4-alkylcyclohexyl esters CHISSO CORPORATION (JP) 1982-07-27 US claimed
EP-0035155-A1 Trans-4\"-alkylcyclohexyl esters of 4'-(2-methylbutyl)-4-biphenylcarboxylic acid and liquid crystal compositions containing same Chisso Corporation (JP) 1981-09-09 EP claimed
JP-61246168-A None JP disclosed
JP-56122334-A None JP disclosed
EP-1726183-B1 OPTICALLY CONTROLLED OPTICAL-PATH-SWITCHING-TYPE DATA DISTRIBUTION APPARATUS AND DISTRIBUTION METHOD DAINICHISEIKA COLOR CHEM (JP) 2012-10-24 EP disclosed
US-7792398-B2 Optically controlled optical-path-switching-type data distribution apparatus and distribution method DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2010-09-07 US disclosed
WO-2005095544-A1 LIQUID CRYSTAL COMPOUNDS, LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2005-10-13 WO disclosed
JP-S61246168-A OPTICALLY ACTIVE PYRIMIDINYL ESTER CHISSO CORP 1986-11-01 JP disclosed
US-RE31715-E ESTERS OF 2-METHYLBUTYLPHENOL THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1984-10-30 US disclosed
JP-S56122334-A LIQUID CRYSTAL 4-ALKYLCYCLOHEXYL ESTER CHISSO CORP 1981-09-25 JP disclosed
EP-0035155-A1 Trans-4\"-alkylcyclohexyl esters of 4'-(2-methylbutyl)-4-biphenylcarboxylic acid and liquid crystal compositions containing same Chisso Corporation (JP) 1981-09-09 EP disclosed
EP-0035155-A1 Trans-4\"-alkylcyclohexyl esters of 4'-(2-methylbutyl)-4-biphenylcarboxylic acid and liquid crystal compositions containing same Chisso Corporation (JP) 1981-09-09 EP disclosed
EP-0035155-A1 Trans-4\"-alkylcyclohexyl esters of 4'-(2-methylbutyl)-4-biphenylcarboxylic acid and liquid crystal compositions containing same Chisso Corporation (JP) 1981-09-09 EP disclosed
US-4257911-A P-ALKYLOXYPHENYL ESTERS OF 4-BRANCHING ALKYL BIPHENYL-4'-CARBOXYLIC ACID; EUTECTIC MIXTURES HAVING CHOLESTIC PHASES AT LOWER TEMPERATURES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1981-03-24 US disclosed
US-4195916-A ELECTROOPTIC DISPLAY DEVICES, OPTICAL PHENOLIC ESTERS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1980-04-01 US disclosed
US-4149413-A THERMOCHROMIC THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHER IRELAND (GB) 1979-04-17 US disclosed
US-4073742-A Cyano-substituted biphenyl compounds and liquid crystalline dielectrics containing the same MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1978-02-14 US disclosed