SCHEMBL19090168

SCHEMBL19090168

CCOc1ccc(-c2ccc(C3(O)CCC(CC)(CC)CC3)cc2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.41
FFAR4 Q5NUL3 2/20 0.34
FGFR2 P21802 2/20 0.33
SLC22A12 Q96S37 2/20 0.33
FGFR1 P11362 1/20 0.33
FPR2 P25090 2/20 0.31
KCNH2 Q12809 1/20 0.31
S1PR1 P21453 1/20 0.31
ESR1 P03372 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
SCHEMBL19090346 0.89 SSTR5 (0.40) SSTR5FFAR4FGFR2FGFR1FPR2
SCHEMBL19090166 0.89 SSTR5 (0.41) SSTR5FFAR4FGFR2SLC22A12FGFR1
SCHEMBL19066491 0.85 SSTR5 (0.39) SSTR5FFAR4FGFR2FGFR1FPR2
SCHEMBL19090067 0.85 SSTR5 (0.38) SSTR5FFAR4FGFR2FGFR1
SCHEMBL19066520 0.84 SSTR5 (0.39) SSTR5FFAR4FGFR2FGFR1
SCHEMBL19090278 0.83 SSTR5 (0.38) SSTR5FFAR4FGFR2FGFR1
SCHEMBL19066506 0.83 SSTR5 (0.38) SSTR5FFAR4FGFR2FGFR1FPR2
SCHEMBL19066490 0.83 SSTR5 (0.37) SSTR5FFAR4ESR1
SCHEMBL19066514 0.82 SSTR5 (0.36) SSTR5FFAR4S1PR1
SCHEMBL19066513 0.82 SSTR5 (0.37) SSTR5FFAR4FGFR2FGFR1

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
WO-2017116213-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME 주식회사 동진쎄미켐 2017-07-06 WO disclosed