SCHEMBL8962944

SCHEMBL8962944

C/C=C/CCC1CCC(C2CCC(c3ccc(-c4ccc(-c5ccc(OCCCC)c(F)c5F)cc4)c(F)c3F)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.32
ALOX5 P09917 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
SCHEMBL8962796 0.97 PTGES (0.30) PTGESALOX5
SCHEMBL8935532 0.97 PTGES (0.33) PTGESALOX5
SCHEMBL8962918 0.96
SCHEMBL8963007 0.96
SCHEMBL8962768 0.96
SCHEMBL8962979 0.96
SCHEMBL8962969 0.95 FPR2 (0.33)
SCHEMBL8935556 0.94 PTGES (0.31) PTGESALOX5
SCHEMBL8935546 0.94 CNR1 (0.31) PTGESALOX5
SCHEMBL8935549 0.94 CNR1 (0.31) PTGESALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed