SCHEMBL13423351

SCHEMBL13423351

C=CC(=O)OCC(O)COc1cccc(OCC(C)O)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.46
▸ TSHR P16473 2/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ ADRB2 P07550 2/20 0.45
▸ ADRB1 P08588 2/20 0.45
▸ ADRB3 P13945 1/20 0.45
▸ THRB P10828 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MTNR1A P48039 3/20 0.41
▸ MTNR1B P49286 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ ACE2 Q9BYF1 1/20 0.40

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
SCHEMBL13423344 0.93 THRB (0.49) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL11650141 0.93 THRB (0.49) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL13423349 0.90 MAPK1 (0.46) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL13779725 0.87 MAPK1 (0.44) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL18492271 0.87 ADRB2 (0.53) ADRB2ADRB1ADRB3THRBSMN1; SMN2
SCHEMBL19456757 0.87 THRB (0.43) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL18392498 0.86 TSHR (0.43) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL18492364 0.85 MAPK1 (0.49) TSHRMAPK1HIF1AADRB2ADRB1
SCHEMBL19129048 0.84 SOD1 (0.43) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL16647277 0.84 THRB (0.41) LMNATSHRMAPK1HIF1AADRB2

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-7678433-B2 Sealant for liquid crystal and liquid-crystal display cell made with the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-03-16 — — US disclosed
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