SCHEMBL20006844

SCHEMBL20006844

CCCc1ccc(F)cc1C#Cc1ccc(-c2ccc3cc(CCc4ccc(C)cc4)ccc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.39
FFAR1 O14842 8/20 0.35
FFAR4 Q5NUL3 2/20 0.35
TAAR1 Q96RJ0 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
SCHEMBL20006847 0.87 HRH3 (0.36) HRH3FFAR1FFAR4TAAR1
SCHEMBL20004739 0.86 HRH3 (0.39) HRH3FFAR1
SCHEMBL20006678 0.83 HRH3 (0.43) HRH3FFAR1FFAR4
SCHEMBL20005284 0.79 HRH3 (0.36) HRH3FFAR1
SCHEMBL20006810 0.78 FFAR1 (0.39) FFAR1FFAR4
SCHEMBL19999433 0.77 RARB (0.40) HRH3
SCHEMBL9742306 0.76 ASIC3 (0.45) HRH3FFAR1
SCHEMBL3167739 0.73 HRH3 (0.48) HRH3FFAR4
SCHEMBL31687978 0.73 HRH3 (0.48) HRH3FFAR4
SCHEMBL20004878 0.73 HRH3 (0.38) HRH3FFAR1

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 2 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