SCHEMBL8518375

SCHEMBL8518375

CC=C[C@H]1CC[C@H](CCc2ccc(-c3ccc(Cl)c(F)c3)cc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.34
PRCP P42785 1/20 0.34
FFAR1 O14842 1/20 0.32
HTR2A P28223 1/20 0.32
GRM2 Q14416 1/20 0.32
MAOB P27338 2/20 0.31
FFAR4 Q5NUL3 1/20 0.31
MCHR1 Q99705 1/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
CHRM4 P08173 1/20 0.31
RARB P10826 2/20 0.30
RARA P10276 1/20 0.30
RARG P13631 1/20 0.30
FPR2 P25090 2/20 0.30
PROKR1 Q8TCW9 2/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL8518373 1.00 GPR84 (0.34) GPR84PRCPFFAR1HTR2AGRM2
SCHEMBL8518372 1.00 GPR84 (0.34) GPR84PRCPFFAR1HTR2AGRM2
SCHEMBL8518370 1.00 GPR84 (0.34) GPR84PRCPFFAR1HTR2AGRM2
SCHEMBL8517306 0.91 GRM2 (0.41) GPR84HTR2AGRM2MAOB
SCHEMBL8517303 0.91 GRM2 (0.41) GPR84HTR2AGRM2MAOB
SCHEMBL8517305 0.91 GRM2 (0.41) GPR84HTR2AGRM2MAOB
SCHEMBL8517300 0.91 GRM2 (0.41) GPR84HTR2AGRM2MAOB
SCHEMBL8517555 0.89 CYP17A1 (0.38) GPR84MAOBRARBRARARARG
SCHEMBL8517558 0.89 CYP17A1 (0.38) GPR84MAOBRARBRARARARG
SCHEMBL8517553 0.89 CYP17A1 (0.38) GPR84MAOBRARBRARARARG

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-0475273-B1 Liquid crystal mixture containing halogenated alcenyl compounds MERCK PATENT GMBH (DE) 1999-04-07 EP disclosed
US-5292452-A Electrooptical devices; high dielectric anisotropy, low rotation viscosity, short response time HOFFMANN-LA ROCHE INC. (US) 1994-03-08 US disclosed
EP-0475273-A1 Halogenated alcenyl compounds F. HOFFMANN-LA ROCHE AG (CH) 1992-03-18 EP disclosed