SCHEMBL20004848

SCHEMBL20004848

Cc1cc(C)c(C#Cc2ccc(F)cc2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 9/20 0.40
FFAR1 O14842 7/20 0.36
FFAR4 Q5NUL3 2/20 0.35
ACHE P22303 1/20 0.33
AAK1 Q2M2I8 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
SCHEMBL20004846 0.89 FFAR1 (0.40) GRM5FFAR1FFAR4ACHE
SCHEMBL19999378 0.83 APP (0.47) FFAR1ACHE
SCHEMBL19401232 0.79 ACHE (0.50) GRM5FFAR1ACHE
SCHEMBL20005204 0.78 ACACB (0.42) FFAR1
SCHEMBL12700650 0.78 FFAR1 (0.40) GRM5FFAR1FFAR4ACHE
SCHEMBL19999533 0.77 FFAR1 (0.33) GRM5FFAR1AAK1
SCHEMBL15984741 0.76 ACHE (0.46) GRM5FFAR1FFAR4ACHE
SCHEMBL19999375 0.75 FFAR1 (0.37) FFAR1FFAR4
SCHEMBL20004813 0.75 CYP2D6 (0.43)
SCHEMBL19999370 0.75 ACACB (0.40) GRM5FFAR1FFAR4

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