SCHEMBL21787294

SCHEMBL21787294

C=C(C)C(=O)Oc1cc(-c2ccc(CCCC(C)(CO)CO)cc2CC)c(OC(=O)C(=C)C)cc1-c1ccc(CCCCC)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.38
THRB P10828 2/20 0.38
THRA P10827 1/20 0.38
TNNC1 P63316 5/20 0.36
S1PR1 P21453 4/20 0.36
S1PR4 O95977 2/20 0.36
S1PR3 Q99500 2/20 0.36
SGPL1 O95470 1/20 0.36
GPR183 P32249 1/20 0.36
CERS2 Q96G23 1/20 0.36
S1PR5 Q9H228 1/20 0.36
RARA P10276 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
MTOR P42345 1/20 0.34
KMT2A Q03164 1/20 0.34
SPHK2 Q9NRA0 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL17070434 0.93 THRB (0.36) RARBTHRBTHRATNNC1S1PR1
SCHEMBL21787423 0.90 RARB (0.35) RARBTHRBTHRATNNC1S1PR1
SCHEMBL17070375 0.90 RARB (0.36) RARBTHRBTHRATNNC1S1PR1
SCHEMBL17070406 0.90 THRB (0.37) RARBTHRBTHRATNNC1S1PR1
SCHEMBL21787295 0.90 RARB (0.37) RARBTHRBTHRATNNC1S1PR1
SCHEMBL17070439 0.88 THRB (0.42) RARBTHRBTHRARARAMEN1
SCHEMBL17070365 0.88 THRB (0.42) RARBTHRBTHRARARAMEN1
SCHEMBL17070369 0.87 RARB (0.37) RARBTHRBTHRATNNC1S1PR1
SCHEMBL17070366 0.84 RARB (0.39) RARBTHRBTHRARARAMEN1
SCHEMBL17070437 0.84 HTT (0.35) THRBTHRATNNC1S1PR1S1PR4

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-11150518-B2 Liquid crystal display device SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2021-10-19 US disclosed
US-20200073180-A1 LIQUID CRYSTAL DISPLAY DEVICE SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-03-05 US disclosed