SCHEMBL20202929

SCHEMBL20202929

CCCCCc1cc(F)c(OCc2ccc(-c3ccc4c(F)c(F)c(F)cc4c3)cc2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.41
RARA P10276 2/20 0.41
RARG P13631 1/20 0.41
FFAR4 Q5NUL3 2/20 0.37
HSD17B10 Q99714 2/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 3/20 0.33
RAB9A P51151 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
NPC1 O15118 1/20 0.33
STAT3 P40763 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 2/20 0.33
MEN1 O00255 1/20 0.33
MTOR P42345 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGS2 P35354 1/20 0.33
SMPD1 P17405 1/20 0.32

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
SCHEMBL20202939 0.97 FFAR4 (0.37) RARBRARARARGFFAR4TSHR
SCHEMBL16210206 0.92 FFAR4 (0.38) RARBRARARARGFFAR4HSD17B10
SCHEMBL20202930 0.90 RARB (0.42) RARBRARARARGFFAR4MAPT
SCHEMBL20202963 0.90 RARB (0.43) RARBRARARARGFFAR4HSD17B10
SCHEMBL20202947 0.90 RARB (0.43) RARBRARARARGFFAR4HSD17B10
SCHEMBL20202938 0.89 ESR1 (0.38) FFAR4MAPTESR1
SCHEMBL20202961 0.87 RARB (0.42) RARBRARARARGHSD17B10TSHR
SCHEMBL20202940 0.87 RARB (0.38) RARBFFAR4PTGS2ESR1
SCHEMBL20202953 0.86 RARB (0.39) RARBRARARARGFFAR4TSHR
SCHEMBL20202942 0.86 RARB (0.39) RARBRARARARGFFAR4TSHR

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-20180148647-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY USING SAME DIC CORPORATION (JP) 2018-05-31 US disclosed