SCHEMBL4653198

SCHEMBL4653198

CCCCC[C@H]1CC[C@H](c2c(C(=O)O)cccc2-c2ccc(C#N)c(F)c2)CC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.37
LTB4R2 Q9NPC1 1/20 0.37
KDM1A O60341 6/20 0.37
SLC22A12 Q96S37 1/20 0.36
RARB P10826 2/20 0.36
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
PTPN11 Q06124 1/20 0.36
EGLN2 Q96KS0 2/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
MCL1 Q07820 1/20 0.35
CHRM4 P08173 1/20 0.35

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
SCHEMBL4823881 0.97 LTB4R2 (0.38) NFE2L2LTB4R2KDM1ASLC22A12EGLN2
SCHEMBL4820159 0.94 KDM1A (0.38) NFE2L2KDM1ASLC22A12EGLN2CYP11B1
SCHEMBL4818950 0.90 EGLN2 (0.38) NFE2L2KDM1ASLC22A12EGLN2CYP11B1
SCHEMBL4651030 0.88 KDM1A (0.38) KDM1ASLC22A12RARBRARARARG
SCHEMBL9764275 0.86 NFE2L2 (0.41) NFE2L2LTB4R2RARBRARARARG
SCHEMBL9764278 0.86 NFE2L2 (0.41) NFE2L2LTB4R2RARBRARARARG
SCHEMBL4650766 0.85 KDM1A (0.39) KDM1ASLC22A12RARBRARARARG
SCHEMBL4651871 0.85 LTB4R2 (0.46) LTB4R2PTPN11CYP11B1CYP11B2CHRM4
SCHEMBL9763570 0.85 NFE2L2 (0.40) NFE2L2LTB4R2RARBRARARARG
SCHEMBL9764355 0.85 NFE2L2 (0.40) NFE2L2LTB4R2RARBRARARARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1599562-B9 NEMATIC LIQUID CRYSTAL MIXTURES FOR BISTABLE DISPLAY DEVICES NEMOPTIC (FR) 2008-09-24 EP claimed
US-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US claimed
EP-1599562-B1 NEMATIC LIQUID CRYSTAL MIXTURES FOR BISTABLE DISPLAY DEVICES NEMOPTIC (FR) 2007-05-16 EP claimed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US claimed
US-7115307-B2 Nematic liquid crystal mixtures for bistable display device NEMOPTIC (FR) 2006-10-03 US claimed
US-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US disclosed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US disclosed