SCHEMBL9134754

SCHEMBL9134754

CC(COC1CCCCC1)OC1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
RGS12 O14924 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
SCHEMBL28415380 0.89 HTT (0.35) HTTMEN1KMT2A
SCHEMBL12968040 0.83 NPC1 (0.36) NPC1KDM4EALDH1A1MAPTHTT
SCHEMBL9435783 0.83 NPC1 (0.32) NPC1
SCHEMBL13676856 0.79 NPC1 (0.40) NPC1KDM4EALDH1A1MAPTHTT
SCHEMBL2328813 0.79 NPC1 (0.40) NPC1KDM4EALDH1A1MAPTHTT
SCHEMBL3414449 0.77 SHBG (0.41) NPC1KDM4E
SCHEMBL108743 0.77 SHBG (0.41) NPC1KDM4E
SCHEMBL6379630 0.77 SHBG (0.41) NPC1KDM4E
SCHEMBL6378601 0.77 SHBG (0.41) NPC1KDM4E
SCHEMBL8077669 0.77 NPC1 (0.37) NPC1KDM4EALDH1A1MAPTHTT

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-103086848-A Dicyclohexylalkyl ether terminal olefines liquid crystal compound and preparation method thereof YANTAI DERUN LIQUID CRYSTAL MATERIALS CO LTD 2013-05-08 CN claimed
CN-101475456-B Method for preparing cyclohexyl formaldehyde by ion liquid catalysis HEBEI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2011-12-28 CN claimed
CN-101475456-A Method for preparing cyclohexyl formaldehyde by ion liquid catalysis UNIV HEBEI SCIENCE & TECH (CN) 2009-07-08 CN claimed
CN-103086848-A Dicyclohexylalkyl ether terminal olefines liquid crystal compound and preparation method thereof YANTAI DERUN LIQUID CRYSTAL MATERIALS CO LTD 2013-05-08 CN disclosed
CN-101475456-B Method for preparing cyclohexyl formaldehyde by ion liquid catalysis HEBEI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2011-12-28 CN disclosed
CN-101475456-A Method for preparing cyclohexyl formaldehyde by ion liquid catalysis UNIV HEBEI SCIENCE & TECH (CN) 2009-07-08 CN disclosed
CN-1043882-C Propylene glycol cyclohexyl ether derivatives, method of producing same and uses thereof ASAHI CHEMICAL IND (JP) 1999-06-30 CN disclosed
US-5414144-A Detergent, solvent, film-forming agent ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1995-05-09 US disclosed
CN-1100712-A Propylene glycol cyclohexyl ether derivatives, method of producing same and uses thereof ASAHI CHEMICAL IND (JP) 1995-03-29 CN disclosed