SCHEMBL20003615

SCHEMBL20003615

Cc1ccc(-c2ccc(-c3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(P)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
PDK2 Q15119 1/20 0.31
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 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
SCHEMBL20003651 0.95 ALOX5AP (0.31) ALOX5APFEN1PDK2
SCHEMBL2741563 0.92 ALOX5AP (0.34) ALOX5APFEN1PDK2PDE3BPDE3A
SCHEMBL18855107 0.92 CYP11B1 (0.31)
SCHEMBL15933152 0.92 ALOX5AP (0.34) ALOX5APFEN1PDK2PDE3BPDE3A
SCHEMBL20003642 0.91 ALOX5AP (0.32) ALOX5APFEN1PDK2PDE3BPDE3A
SCHEMBL12625439 0.90 ALOX5AP (0.36) ALOX5APFEN1PDK2PDE3BPDE3A
SCHEMBL18855112 0.90 AKR1C3 (0.34) ALOX5APFEN1AKR1C3AKR1C2
SCHEMBL19159269 0.89 PDK2 (0.32) PDK2
SCHEMBL17951017 0.88 PDE3B (0.34) ALOX5APFEN1PDK2PDE3BPDE3A
SCHEMBL12624690 0.88 ALOX5AP (0.39) ALOX5APFEN1PDK2PDE3BPDE3A

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
EP-2792728-B1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT, AND LIQUID CRYSTAL DISPLAY DAINIPPON INK & CHEMICALS (JP) 2018-03-28 EP disclosed