SCHEMBL8079276

SCHEMBL8079276

BrC(C1CCCCC1)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 2/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GMNN O75496 1/20 0.36
MAPT P10636 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2D6 P10635 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
MLNR O43193 1/20 0.31
ABCB11 O95342 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL3811607 1.00 EPHX1 (0.41) EPHX1SHBGTP53ALDH1A1HSD17B10
SCHEMBL31094806 0.89 EPHX1 (0.30) EPHX1SHBG
SCHEMBL9966985 0.81
SCHEMBL4453651 0.79
SCHEMBL16734999 0.76
SCHEMBL16933875 0.74
SCHEMBL30895678 0.73
SCHEMBL909432 0.73
SCHEMBL14118516 0.73
SCHEMBL2844353 0.71 EPHX1 (0.43) EPHX1SHBGTP53ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117326907-A Synthesis method of trans, trans-4-alkyldicyclohexyl-4' -amyl-3 (E) alkene liquid crystal monomer 江苏广域化学有限公司 2024-01-02 CN claimed
EP-0523928-A2 Kink resistant, flexible, radiopaque polyurethane tubing and catheters formed therefrom CRITIKON, INC. (US) 1993-01-20 EP claimed
CN-117326907-A Synthesis method of trans, trans-4-alkyldicyclohexyl-4' -amyl-3 (E) alkene liquid crystal monomer 江苏广域化学有限公司 2024-01-02 CN disclosed
CN-117326907-A Synthesis method of trans, trans-4-alkyldicyclohexyl-4' -amyl-3 (E) alkene liquid crystal monomer 江苏广域化学有限公司 2024-01-02 CN disclosed
CN-102876332-B Liquid crystal compound and application thereof BEIJING BAYI SPACE LCD MATERIALS TECHNOLOGY CO LTD 2015-01-28 CN disclosed
CN-102851035-B Nematic liquid crystal compound and applications thereof BEIJING BAYI SPACE LCD MATERIALS TECHNOLOGY CO LTD 2014-03-26 CN disclosed
CN-102876332-A Liquid crystal compound and application thereof BEIJING BAYI SPACE LCD MATERIALS TECHNOLOGY CO LTD 2013-01-16 CN disclosed
CN-102851035-A Nematic liquid crystal compound and applications thereof BEIJING BAYI SPACE LCD MATERIALS TECHNOLOGY CO LTD 2013-01-02 CN disclosed
JP-2000256307-A THIOETHER COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING NEGATIVE VALUE OF PERMITTIVITY ANISOTROPY CHISSO CORP 2000-09-19 JP disclosed