SCHEMBL9524889

SCHEMBL9524889

CCCCCCCCOc1ncc(-c2ccc(OCC3COC4(CCCCC4)O3)cc2)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 3/20 0.42
HTR1A P08908 3/20 0.42
ADRA1B P35368 3/20 0.42
ADRA1A P35348 2/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RARB P10826 3/20 0.34
PABPC1 P11940 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
CYP3A4 P08684 4/20 0.34
CYP2D6 P10635 4/20 0.34
CYP2C9 P11712 3/20 0.34
CYP2C19 P33261 3/20 0.34
CYP19A1 P11511 2/20 0.34
LTA4H P09960 1/20 0.33
TMEM97 Q5BJF2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL7502807 1.00 ADRA1D (0.42) ADRA1DHTR1AADRA1BADRA1AKDM4E
SCHEMBL9524945 0.88 HTR1A (0.40) ADRA1DHTR1AADRA1BADRA1AKDM4E
SCHEMBL9524949 0.88 HTR1A (0.40) ADRA1DHTR1AADRA1BADRA1AKDM4E
SCHEMBL9525003 0.88 KDM4E (0.38) KDM4EALDH1A1HPGDHTTL3MBTL1
SCHEMBL9524995 0.88 KDM4E (0.38) KDM4EALDH1A1HPGDHTTL3MBTL1
SCHEMBL9175202 0.86 ADRA1D (0.44) ADRA1DHTR1AADRA1BADRA1AKDM4E
SCHEMBL9524654 0.86 ADRA1D (0.38) ADRA1DHTR1AADRA1BADRA1AKDM4E
SCHEMBL9524658 0.86 ADRA1D (0.38) ADRA1DHTR1AADRA1BADRA1AKDM4E
SCHEMBL8874773 0.81 RARB (0.36) ADRA1DHTR1AADRA1BKDM4EALDH1A1
SCHEMBL8874776 0.81 RARB (0.36) ADRA1DHTR1AADRA1BKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158020-B2 Liquid crystal element, optical path deflecting element, and image displaying apparatus RICOH COMPANY, LTD. (JP) 2012-04-17 US disclosed
US-20080204608-A1 Liquid Crystal Element, Optical Path Deflecting Element, and Image Displaying Apparatus RICOH COMPANY, LTD. (JP) 2008-08-28 US disclosed
EP-0351746-B1 Optically active 1,3-dioxolane derivatives containing a mesogene group in position 4, method for their preparation and their use as doping agents in liquid-crystal mixtures HOECHST AG (DE) 1993-12-29 EP disclosed
EP-0351746-A1 Optically active 1,3-dioxolane derivatives containing a mesogene group in position 4, method for their preparation and their use as doping agents in liquid-crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1990-01-24 EP disclosed