SCHEMBL22269641

SCHEMBL22269641

CCOc1ccc(-c2ccc(-c3ccc(CCC4CCC5(CC4)OCCO5)cc3)cc2)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.40
GPR119 Q8TDV5 2/20 0.34
ALDH1A1 P00352 1/20 0.32
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 1/20 0.30
C5AR1 P21730 1/20 0.30
GRM2 Q14416 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
SCHEMBL17827774 0.85 FFAR4 (0.47) FFAR4S1PR1S1PR3RXRARXRB
SCHEMBL22277497 0.83 FFAR4 (0.44) FFAR4S1PR1S1PR3RXRARXRB
SCHEMBL22277356 0.83 FFAR4 (0.44) FFAR4S1PR1S1PR3RXRARXRB
SCHEMBL1311986 0.82 FFAR4 (0.45) FFAR4S1PR1S1PR3RXRARXRB
SCHEMBL9406087 0.82 FFAR4 (0.45) FFAR4S1PR1S1PR3RXRARXRB
SCHEMBL11894452 0.81 TRPV3 (0.35) FFAR4ALDH1A1
SCHEMBL12113639 0.81 FFAR4 (0.44) FFAR4ALDH1A1S1PR1S1PR3RXRA
SCHEMBL22269637 0.81 FFAR4 (0.44) FFAR4ALDH1A1RXRARXRBRXRG
SCHEMBL22277543 0.79 FFAR4 (0.43) FFAR4S1PR1S1PR3RXRARXRB
SCHEMBL22277679 0.79 FFAR4 (0.43) FFAR4S1PR1S1PR3RXRARXRB

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-20200239775-A1 TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-07-30 US disclosed
EP-3406585-B1 TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2020-07-29 EP disclosed