SCHEMBL20006745

SCHEMBL20006745

Cc1ccc(-c2ccc(-c3cc(F)c(C#Cc4cc(F)c(C(F)(F)Oc5cc(F)c(F)c(F)c5)cc4C)c(F)c3)c(F)c2)c(F)c1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL20006835 0.88
SCHEMBL20006946 0.87 ALOX5AP (0.32) ALOX5APFEN1
SCHEMBL19999577 0.85 RARB (0.35)
SCHEMBL20005292 0.84 AKR1C3 (0.32) AKR1C3AKR1C2
SCHEMBL16866173 0.83 ALOX5AP (0.37) AKR1C3AKR1C2ALOX5APFEN1
SCHEMBL20006833 0.80 AR (0.33)
SCHEMBL19999582 0.80
SCHEMBL19999575 0.80 S1PR1 (0.32) ALOX5APFEN1
SCHEMBL15785459 0.80 CYP11B1 (0.34) AKR1C3AKR1C2ALOX5APFEN1
SCHEMBL20006713 0.79 ALOX5AP (0.30) ALOX5APFEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10208249-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-02-19 US disclosed
US-20180086979-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-03-29 US disclosed