SCHEMBL20174174

SCHEMBL20174174

C=C(C)C(=O)OCc1ccc(-c2ccc(OC(=O)CCc3ccc(COC(=O)C(=C)C)c(COC(=O)C(=C)C)c3)c(F)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 12/20 0.35
AKR1C2 P52895 2/20 0.35
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 1/20 0.33
S1PR5 Q9H228 1/20 0.33
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CYP17A1 P05093 1/20 0.31

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
SCHEMBL22460832 0.95 AKR1C3 (0.32) AKR1C3AKR1C2S1PR1S1PR3S1PR5
SCHEMBL16977634 0.84 CYP17A1 (0.39) NPC1RAB9ACYP17A1
SCHEMBL24019227 0.80 KMT2A (0.41) AKR1C3AKR1C2S1PR1KMT2ACYP17A1
SCHEMBL16803375 0.80 KMT2A (0.39) AKR1C3AKR1C2S1PR1S1PR3S1PR5
SCHEMBL20626668 0.80 ADRB2 (0.43) AKR1C3AKR1C2S1PR1S1PR3S1PR5
SCHEMBL20174184 0.79 FAAH (0.37) AKR1C3AKR1C2S1PR1
SCHEMBL17189608 0.78 S1PR1 (0.39) AKR1C3AKR1C2S1PR1S1PR3S1PR5
SCHEMBL26036299 0.78 FAAH (0.43) AKR1C3AKR1C2S1PR1S1PR3S1PR5
SCHEMBL13289599 0.77 MAOB (0.39) S1PR1KMT2A
SCHEMBL17754312 0.77 APP (0.41) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200301213-A1 LIQUID CRYSTAL DISPLAY ELEMENT AND METHOD FOR MANUFACTURING SAME DIC CORPORATION (JP) 2020-09-24 US disclosed
US-20180142155-A1 LIQUID CRYSTAL DISPLAY DEVICE AND METHOD FOR MANUFACTURING SAME DIC CORPORATION (JP) 2018-05-24 US disclosed
US-20180142155-A1 LIQUID CRYSTAL DISPLAY DEVICE AND METHOD FOR MANUFACTURING SAME DIC CORPORATION (JP) 2018-05-24 US disclosed