SCHEMBL20202931

SCHEMBL20202931

CCCc1cc(F)c(C(F)(F)Oc2ccc(-c3ccc4c(F)c(F)c(F)cc4c3)c(F)c2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
GRM2 Q14416 1/20 0.35
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
HMOX1 P09601 1/20 0.32
FFAR4 Q5NUL3 3/20 0.32
FFAR1 O14842 1/20 0.32
CYP2C9 P11712 1/20 0.32
CACNA1C Q13936 1/20 0.32
S1PR1 P21453 2/20 0.31
S1PR3 Q99500 2/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
METAP2 P50579 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
SCHEMBL20202933 0.94 ALOX5AP (0.36) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL17075778 0.94 ALOX5AP (0.34) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL20202946 0.94 ALOX5AP (0.39) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL20202932 0.93 RARB (0.37) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL20202949 0.91 GRM2 (0.33) ALOX5APFEN1GRM2
SCHEMBL20202941 0.89 GSK3B (0.34)
SCHEMBL17083207 0.89 ALOX5AP (0.34) ALOX5APFEN1GRM2S1PR1S1PR3
SCHEMBL20936231 0.87 ALOX5AP (0.40) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL20202970 0.85 RARB (0.31)
SCHEMBL17083187 0.85 RARB (0.31)

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