SCHEMBL22361791

SCHEMBL22361791

C=CC(=O)OCCCCOc1ccc(C(O)Oc2ccc(OC(=O)c3ccc(COc4ccccc4B(O)O)cc3)c(C)c2C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 2/20 0.36
▸ THRB P10828 1/20 0.35
▸ RAB9A P51151 5/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ BCHE P06276 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ ADRB2 P07550 1/20 0.32
▸ ADRB1 P08588 1/20 0.32
▸ ADRB3 P13945 1/20 0.32
▸ FFAR1 O14842 1/20 0.32
▸ RXRA P19793 2/20 0.32
▸ RXRB P28702 2/20 0.32
▸ RXRG P48443 1/20 0.32

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
SCHEMBL19295738 0.92 LIPE (0.42) LIPETHRBRAB9AL3MBTL1MAPT
SCHEMBL22361793 0.90 FFAR1 (0.35) THRBRAB9AMAPTMEN1KMT2A
SCHEMBL22361792 0.87 ENPP2 (0.35) THRBRAB9AL3MBTL1MAPTTDP1
SCHEMBL22361660 0.87 FFAR1 (0.35) THRBRAB9AL3MBTL1MAPTLMNA
SCHEMBL22419410 0.86 NPC1 (0.35) THRBMAPTLMNATDP1MEN1
SCHEMBL19302434 0.84 THRB (0.35) THRBL3MBTL1MAPTLMNATDP1
SCHEMBL22555934 0.81 THRB (0.49) THRBRAB9AL3MBTL1MAPTLMNA
SCHEMBL29419498 0.81 THRB (0.49) THRBRAB9AL3MBTL1MAPTLMNA
SCHEMBL17833478 0.81 THRB (0.38) THRBRAB9AMAPTMEN1KMT2A
SCHEMBL16945726 0.81 THRB (0.38) THRBRAB9AMAPTMEN1KMT2A

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-10752778-B2 Resin composition containing surface-modified inorganic substance, thermally conductive material, and device FUJIFILM CORPORATION (JP) 2020-08-25 — — US disclosed
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