SCHEMBL8037586

SCHEMBL8037586

C=CCCC1=CCC(C2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
EPHX2 P34913 2/20 0.32
KDM1A O60341 1/20 0.31
RCOR1 Q9UKL0 1/20 0.31
TEAD1 P28347 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
FAAH O00519 1/20 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
SCHEMBL8049736 0.88 ALDH1A1 (0.33)
SCHEMBL8050501 0.88 L3MBTL1 (0.37) L3MBTL1EPHX2KDM1ARCOR1TEAD1
SCHEMBL8049149 0.85 ALDH1A1 (0.31)
SCHEMBL8037462 0.85 HTR2C (0.39)
SCHEMBL8037733 0.85 TEAD1 (0.34) EPHX2TEAD1
SCHEMBL8055148 0.85 IDO1 (0.34)
SCHEMBL8049047 0.85
SCHEMBL8049001 0.84 L3MBTL1 (0.40) L3MBTL1EPHX2KDM1ARCOR1TEAD1
SCHEMBL8047742 0.84
SCHEMBL8052555 0.83 TEAD1 (0.35) L3MBTL1KDM1ARCOR1TEAD1

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