SCHEMBL9556243

SCHEMBL9556243

CCCCCC1CCC(CCC2COC(c3ccc(F)cc3)OC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.40
TP53 P04637 4/20 0.36
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
EPHX1 P07099 1/20 0.33
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
PKM P14618 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
SCHEMBL9556238 1.00 GRM2 (0.40) GRM2TP53MAPTPOLBGAA
SCHEMBL10432817 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL9556221 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL9556226 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL9556381 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL9556438 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL10432818 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL9556100 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL9556432 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA
SCHEMBL9556378 0.99 GRM2 (0.41) GRM2TP53MAPTPOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0400861-A1 1,3-dioxane derivative and liquid crystal composition incorporating the same SEIKO EPSON CORPORATION (JP) 1990-12-05 EP claimed
US-5238599-A Low threshold voltage, low driving voltage SEIKO EPSON CORPORATION (JP) 1993-08-24 US disclosed
EP-0400861-A1 1,3-dioxane derivative and liquid crystal composition incorporating the same SEIKO EPSON CORPORATION (JP) 1990-12-05 EP disclosed