SCHEMBL8046795

SCHEMBL8046795

CC#CCc1ccc(C#Cc2cc(F)c(C3CCC(C)CC3)c(F)c2)cc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.31
ESR2 Q92731 1/20 0.30
FFAR1 O14842 1/20 0.30
GRIN2B Q13224 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
SCHEMBL8039870 0.90 ACACB (0.30) ACACB
SCHEMBL8046434 0.88 TNK2 (0.30)
SCHEMBL8039827 0.87 PANK3 (0.31) FFAR1
SCHEMBL8040832 0.86 TNK2 (0.35) FFAR1
SCHEMBL8040594 0.85 ACACB (0.32) ACACBGRIN2B
SCHEMBL8041002 0.85 FFAR1 (0.36) FFAR1
SCHEMBL8040154 0.82 ESR2 (0.45) ACACBESR2FFAR1
SCHEMBL8041509 0.77 FFAR1 (0.39) ACACBFFAR1
SCHEMBL8040994 0.77 CYP2C9 (0.32)
SCHEMBL8029228 0.77 FFAR1 (0.30) FFAR1

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
EP-0727473-B1 Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 2000-01-12 EP disclosed
US-5833879-A LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES CHISSO CORPORATION (JP) 1998-11-10 US disclosed
EP-0727473-A2 Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1996-08-21 EP disclosed