SCHEMBL19644908

SCHEMBL19644908

CC(C)Oc1ccc(-c2ccc(-c3ccc(OC(C)C)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
FFAR4 Q5NUL3 4/20 0.35
TRPV3 Q8NET8 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
NAAA Q02083 1/20 0.33
S1PR1 P21453 4/20 0.33
S1PR3 Q99500 2/20 0.33
CSNK2A1 P68400 2/20 0.33
MCL1 Q07820 1/20 0.32
KCNN4 O15554 1/20 0.32
S1PR5 Q9H228 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
SCHEMBL26769952 0.85 CSNK2A1 (0.39) FFAR4RXRARXRBRXRGCSNK2A1
SCHEMBL21396248 0.82 FFAR4 (0.33) FFAR4
SCHEMBL25835370 0.77 FFAR4 (0.37) FFAR4TRPV3CSNK2A1KCNN4
SCHEMBL23996081 0.77 PDE4B (0.37) CSNK2A1
SCHEMBL28826439 0.76 HTR1A (0.42) ALOX5APFEN1KCNN4
SCHEMBL25821548 0.75 CSNK2A1 (0.34) FFAR4CSNK2A1KCNN4
SCHEMBL17084300 0.74 MAPT (0.35)
SCHEMBL22208469 0.73 HSD17B1 (0.38) FFAR4CSNK2A1
SCHEMBL17048355 0.73 POLB (0.37) ALOX5APFEN1FFAR4CSNK2A1
SCHEMBL15576315 0.73 CSNK2A1 (0.33) FFAR4RXRARXRBRXRGCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828548-B2 Liquid-crystal composition DIC CORPORATION (JP) 2017-11-28 US disclosed