SCHEMBL7569413

SCHEMBL7569413

[C]#CC(C#CCCCCCCCCCC)CCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.40
PTPN7 P35236 4/20 0.36
RECQL P46063 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.33
DNM1 Q05193 1/20 0.32
KCNH2 Q12809 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
SCHEMBL5517525 1.00 HMGCR (0.40) HMGCRPTPN7RECQLTDP1LMNA
SCHEMBL4195332 1.00 HMGCR (0.40) HMGCRPTPN7RECQLTDP1LMNA
SCHEMBL6775172 1.00 HMGCR (0.40) HMGCRPTPN7RECQLTDP1LMNA
SCHEMBL11010189 0.93 HMGCR (0.36) HMGCRPTPN7RECQLTDP1
SCHEMBL18422774 0.88 TSHR (0.36) DNM1
SCHEMBL28429553 0.84 TSHR (0.36)
SCHEMBL3040799 0.78 TSHR (0.37)
SCHEMBL19206680 0.77
SCHEMBL28474184 0.74 HMGCR (0.38) HMGCRPTPN7RECQLTDP1LMNA
SCHEMBL559717 0.74 LMNA (0.37) LMNADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0709444-B1 Liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL CO (JP) 2002-09-18 EP disclosed
EP-0709444-A1 Liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-05-01 EP disclosed