SCHEMBL20202968

SCHEMBL20202968

CCc1ccc(-c2ccc(-c3cc(F)c(C(F)(F)Oc4ccc5c(F)c(F)c(F)cc5c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
GRM2 Q14416 1/20 0.35
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 1/20 0.30
CHRM5 P08912 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
SCHEMBL20202966 0.94 ALOX5AP (0.34) ALOX5APFEN1GRM2
SCHEMBL17083207 0.93 ALOX5AP (0.34) ALOX5APFEN1GRM2
SCHEMBL20202959 0.92 PPM1A (0.30) GRM2
SCHEMBL20202967 0.92 PPM1A (0.30) GRM2
SCHEMBL17719460 0.91 RARB (0.36) ALOX5APFEN1GRM2
SCHEMBL20202969 0.90 RARB (0.39) ALOX5APFEN1GRM2
SCHEMBL18193773 0.89 ALOX5AP (0.36) ALOX5APFEN1GRM2
SCHEMBL12624691 0.89 GRM2 (0.41) ALOX5APFEN1GRM2CHRM5
SCHEMBL20202949 0.89 GRM2 (0.33) ALOX5APFEN1GRM2
SCHEMBL20202946 0.87 ALOX5AP (0.39) ALOX5APFEN1GRM2AKR1C3AKR1C2

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