SCHEMBL19829108

SCHEMBL19829108

CCc1ccc(-c2ccc(C(F)(F)Oc3cc(F)c(OCF)c(F)c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.35
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
SERPINE1 P05121 1/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
FFAR1 O14842 1/20 0.31
MAOB P27338 1/20 0.31
FAAH O00519 1/20 0.30
KIF11 P52732 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
SCHEMBL19829155 0.90 MAOB (0.35) FFAR4RXRARXRBRXRGMAOB
SCHEMBL19829125 0.87 MAOB (0.39) FFAR4MAOB
SCHEMBL19829154 0.87 FFAR4 (0.33) FFAR4PPARD
SCHEMBL16258067 0.85 MAOB (0.34) RXRARXRBRXRGSERPINE1PPARG
SCHEMBL19829204 0.84 S1PR1 (0.35) FFAR4
SCHEMBL19829202 0.83 S1PR1 (0.36) FFAR1MAOBKIF11
SCHEMBL7731008 0.82 TSHR (0.35) SERPINE1PPARDPPARA
SCHEMBL19829122 0.82 MAOB (0.33) FFAR4MAOB
SCHEMBL7735331 0.81 KIF11 (0.33) MAOBKIF11
SCHEMBL7729773 0.80 TSHR (0.40) SERPINE1PPARDPPARAKIF11

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
US-20180030351-A1 LIQUID CRYSTAL COMPOUND HAVING POLYFLUORO-2-BUTENOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-02-01 US disclosed