SCHEMBL8050118

SCHEMBL8050118

C=CCCC1=CCC(C2CCC(c3ccc(C#N)c(F)c3)CC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FASN P49327 2/20 0.31
KDM1A O60341 2/20 0.31

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
SCHEMBL8049191 0.87 USP5 (0.30)
SCHEMBL8048836 0.83 GRIA1 (0.33)
SCHEMBL8037821 0.82
SCHEMBL8047742 0.81
SCHEMBL8037810 0.80 CYP11B1 (0.36)
SCHEMBL8049022 0.80 HRH3 (0.33)
SCHEMBL8049047 0.80
SCHEMBL8052410 0.79
SCHEMBL8047929 0.78 PTGS1 (0.31)
SCHEMBL7739045 0.77 TRPV4 (0.35) FASNKDM1A

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-0728829-B1 Liquid crystalline alkenylcyclohexene derivative, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 2000-05-03 EP disclosed
US-5698136-A LOW TEMPERATURE COMPATIBILITY, CHEMICAL STABILITY CHISSO CORPORATION (JP) 1997-12-16 US disclosed
EP-0728829-A2 Liquid crystalline alkenylcyclohexene derivative, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1996-08-28 EP disclosed