SCHEMBL20005184

SCHEMBL20005184

CCCc1ccc(C#Cc2c(F)cc(C#Cc3ccc(C)cc3)cc2CC)cc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.43
ACACB O00763 5/20 0.38
FFAR4 Q5NUL3 2/20 0.36
CYP1A2 P05177 1/20 0.33
CYP2A6 P11509 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33

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
SCHEMBL8978868 0.90 FFAR1 (0.45) FFAR1ACACBCYP1A2CYP2A6TAAR1
SCHEMBL8978909 0.90 FFAR1 (0.45) FFAR1ACACBCYP1A2CYP2A6TAAR1
SCHEMBL20006846 0.90 FFAR1 (0.38) FFAR1ACACBFFAR4
SCHEMBL12611127 0.87 HSD17B10 (0.42) FFAR1ACACBFFAR4
SCHEMBL15430815 0.87 HSD17B10 (0.42) FFAR1ACACBFFAR4
SCHEMBL8978955 0.84 ACACB (0.42) FFAR1ACACBFFAR4
SCHEMBL8978833 0.83 ACACB (0.40) FFAR1ACACBFFAR4CYP2A6TAAR1
SCHEMBL8978971 0.83 ACACB (0.40) FFAR1ACACBFFAR4CYP2A6TAAR1
SCHEMBL8979017 0.82 FFAR1 (0.43) FFAR1CYP1A2CYP2A6TAAR1
SCHEMBL8978832 0.82 FFAR1 (0.43) FFAR1CYP1A2CYP2A6TAAR1

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
US-10208249-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-02-19 US disclosed
US-20180086979-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-03-29 US disclosed
EP-3299439-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2018-03-28 EP disclosed