SCHEMBL8979134

SCHEMBL8979134

Cc1ccc(C#Cc2ccc(C#Cc3ccc(C)cc3)c(F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.42
CA12 O43570 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
CA1 P00915 2/20 0.41
KCNH2 Q12809 1/20 0.40
FFAR1 O14842 5/20 0.40
FFAR4 Q5NUL3 4/20 0.40
ACACB O00763 1/20 0.38
NR3C2 P08235 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP2A6 P11509 1/20 0.37
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36

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
SCHEMBL10091204 0.93 FFAR1 (0.49) GRM5CA12CA2CA9CA1
SCHEMBL7858970 0.93 FFAR1 (0.39) GRM5CA12CA2CA9CA1
SCHEMBL7851710 0.93 FFAR1 (0.39) GRM5CA12CA2CA9CA1
SCHEMBL7858588 0.92 GRM5 (0.42) GRM5CA12CA2CA9CA1
SCHEMBL10018724 0.92 GRM5 (0.42) GRM5CA12CA2CA9CA1
SCHEMBL8979196 0.91 ALDH1A1 (0.53) GRM5CA12CA2CA9CA1
SCHEMBL8978989 0.91 ALDH1A1 (0.53) GRM5CA12CA2CA9CA1
SCHEMBL8978766 0.88 FFAR1 (0.43) GRM5CA12CA2CA9CA1
SCHEMBL8978996 0.88 FFAR1 (0.43) GRM5CA12CA2CA9CA1
SCHEMBL12699104 0.88 FFAR1 (0.38) GRM5CA12CA2CA9CA1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11208594-B2 Liquid-crystalline medium and high-frequency components comprising same MERCK PATENT GMBH (DE) 2021-12-28 US disclosed
US-20170349827-A1 LIQUID-CRYSTALLINE MEDIUM AND HIGH-FREQUENCY COMPONENTS COMPRISING SAME MERCK PATENT GMBH (DE) 2017-12-07 US disclosed
US-20170349827-A1 LIQUID-CRYSTALLINE MEDIUM AND HIGH-FREQUENCY COMPONENTS COMPRISING SAME MERCK PATENT GMBH (DE) 2017-12-07 US disclosed
EP-0581272-B1 Tolane derivatives, liquid crystal compositions containing the derivatives and liquid crystal display device using the compositions SEIKO EPSON CORP (JP) 1996-05-08 EP disclosed
US-5356558-A Compatibility, high speed response SEIKO EPSON CORPORATION (JP) 1994-10-18 US disclosed
EP-0581272-A1 Tolane derivatives, liquid crystal compositions containing the derivatives and liquid crystal display device using the compositions SEIKO EPSON CORPORATION (JP) 1994-02-02 EP disclosed