SCHEMBL17951018

SCHEMBL17951018

Cc1ccc(-c2cc(F)c(C(F)(F)Oc3ccc(-c4ccc(-c5cc(F)c(F)c(F)c5)c(F)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.40
FEN1 P39748 2/20 0.40
GPR3 P46089 1/20 0.35
GRM2 Q14416 1/20 0.33
ERN1 O75460 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
APP P05067 1/20 0.31
CYP2C19 P33261 1/20 0.31
PTGS2 P35354 1/20 0.30
RPS6KA3 P51812 1/20 0.30
PDK2 Q15119 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL15374870 0.99 ALOX5AP (0.39) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL14767335 0.99 ALOX5AP (0.39) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL12814531 0.97 ALOX5AP (0.38) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL12624690 0.96 ALOX5AP (0.39) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL12625439 0.94 ALOX5AP (0.36) ALOX5APFEN1GPR3ERN1PDE3B
SCHEMBL15933152 0.92 ALOX5AP (0.34) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL2741563 0.92 ALOX5AP (0.34) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL14235285 0.92 ALOX5AP (0.39) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL11891864 0.91 ALOX5AP (0.39) ALOX5APFEN1GPR3GRM2ERN1
SCHEMBL17951017 0.91 PDE3B (0.34) ALOX5APFEN1GRM2PDE3BPDE3A

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-20160215217-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2016-07-28 US disclosed