SCHEMBL20005208

SCHEMBL20005208

CCC(F)(F)Cc1ccc2cc(-c3ccc(-c4ccc(C#Cc5c(C)cc(CCc6ccc(C)cc6)cc5F)cc4)cc3)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.38
FFAR1 O14842 3/20 0.32
TSHR P16473 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL19999550 0.95 HRH3 (0.38) HRH3FFAR1TSHRHSD17B10
SCHEMBL20005276 0.85 FFAR1 (0.42) FFAR1TSHRHSD17B10
SCHEMBL20005274 0.83 TSHR (0.43) FFAR1TSHRHSD17B10
SCHEMBL20005244 0.81 RARB (0.40) HRH3FFAR1TSHRHSD17B10
SCHEMBL20004889 0.78 RARB (0.39) HRH3FFAR1TSHRHSD17B10
SCHEMBL19999462 0.77 TSHR (0.44) FFAR1TSHRHSD17B10
SCHEMBL20004902 0.77 RARB (0.37) HRH3FFAR1TSHRHSD17B10
SCHEMBL20006853 0.77 FFAR1 (0.40) FFAR1TSHRHSD17B10
SCHEMBL20005246 0.77 ESR1 (0.36) HRH3
SCHEMBL19999492 0.76 TSHR (0.44) HRH3TSHRHSD17B10

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
EP-3299439-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2018-03-28 EP disclosed