SCHEMBL20006812

SCHEMBL20006812

CCCCc1ccc(C#Cc2cc(F)ccc2OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.42
AAK1 Q2M2I8 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
NR3C1 P04150 1/20 0.38
PGR P06401 1/20 0.38
NR3C2 P08235 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
BCHE P06276 1/20 0.38

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
SCHEMBL19999380 0.85 FFAR1 (0.42) FFAR1PPARGPPARA
SCHEMBL9510638 0.83 KDM4E (0.41)
SCHEMBL9509124 0.83 FFAR1 (0.42) FFAR1
SCHEMBL20006811 0.82 FFAR1 (0.48) FFAR1FFAR4
SCHEMBL19999423 0.82 FFAR1 (0.39) FFAR1AAK1FFAR4BCHE
SCHEMBL20006810 0.81 FFAR1 (0.39) FFAR1FFAR4
SCHEMBL9510224 0.81 TSHR (0.43) FFAR1AAK1
SCHEMBL19999365 0.80 FFAR1 (0.39) FFAR1PPARGPPARAHTR2A
SCHEMBL9416292 0.80 HSD17B10 (0.43) FFAR1FFAR4HTR2AHTR2C
SCHEMBL8457261 0.80 FFAR1 (0.64) FFAR1PPARGPPARAFFAR4

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