SCHEMBL20202953

SCHEMBL20202953

CCCCc1ccc(-c2ccc(-c3cc(F)c(OCc4ccc5c(F)c(F)c(F)cc5c4)c(F)c3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.39
RARA P10276 2/20 0.39
RARG P13631 1/20 0.39
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
FFAR4 Q5NUL3 2/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
EIF4A1 P60842 3/20 0.32
GPR84 Q9NQS5 1/20 0.32
MPL P40238 2/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DHODH Q02127 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
SCHEMBL20202942 1.00 RARB (0.39) RARBRARARARGNPC1RAB9A
SCHEMBL20202963 0.97 RARB (0.43) RARBRARARARGRAB9ASMN1; SMN2
SCHEMBL20202947 0.97 RARB (0.43) RARBRARARARGRAB9ASMN1; SMN2
SCHEMBL20202952 0.93 FFAR4 (0.34) RARBRARARARGNPC1RAB9A
SCHEMBL20202937 0.93 FFAR4 (0.34) RARBRARARARGNPC1RAB9A
SCHEMBL20202964 0.93 RARB (0.38) RARBRARARARGMPL
SCHEMBL20202939 0.90 FFAR4 (0.37) RARBRARARARGNPC1RAB9A
SCHEMBL20202961 0.90 RARB (0.42) RARBRARARARGTP53TSHR
SCHEMBL20202936 0.89 FFAR4 (0.35) FFAR4L3MBTL1
SCHEMBL20202962 0.89 FFAR4 (0.35) FFAR4L3MBTL1

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