SCHEMBL23635492

SCHEMBL23635492

C=C(CO)C(=O)OCCOc1cc(OCCOC(=O)C(C)(C)CO)cc(-c2ccc(OCCOC3CCC(CCCCC)CC3)cc2)c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 5/20 0.33
▸ ITGB3 P05106 3/20 0.33
▸ ITGA2B P08514 3/20 0.33
▸ RARA P10276 1/20 0.32
▸ S1PR5 Q9H228 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ DGAT1 O75907 1/20 0.31
▸ CNR1 P21554 5/20 0.30
▸ CNR2 P34972 5/20 0.30
▸ PPARG P37231 1/20 0.30
▸ PDE4A P27815 1/20 0.30
▸ PDE4D Q08499 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
SCHEMBL20313549 0.94 RARB (0.37) RARBITGB3ITGA2BRARACNR1
SCHEMBL20322718 0.90 ITGB3 (0.34) RARBITGB3ITGA2BRARAS1PR5
SCHEMBL20322738 0.88 RAB9A (0.33) RARBDGAT1CNR1CNR2PPARG
SCHEMBL20322673 0.88 RAB9A (0.33) RARBDGAT1CNR1CNR2PPARG
SCHEMBL20407605 0.88 ITGB3 (0.34) RARBITGB3ITGA2BRARACNR1
SCHEMBL20322644 0.87 RARB (0.38) RARBITGB3ITGA2BRARAS1PR1
SCHEMBL23635468 0.86 RAB9A (0.39) ITGB3ITGA2BS1PR5CNR1CNR2
SCHEMBL20322593 0.86 ITGB3 (0.33) RARBITGB3ITGA2BRARA
SCHEMBL20322883 0.85 CNR1 (0.30) CNR1CNR2
SCHEMBL20322627 0.85 RARA (0.35) RARBRARADGAT1

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-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 — — US disclosed
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