SCHEMBL13423349

SCHEMBL13423349

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

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.46
▸ TSHR P16473 2/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ THRB P10828 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ ADRB2 P07550 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ ADRB3 P13945 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ TP53 P04637 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
SCHEMBL11650141 0.93 THRB (0.49) MAPK1TSHRHIF1ATHRBSMN1; SMN2
SCHEMBL13423344 0.93 THRB (0.49) MAPK1TSHRHIF1ATHRBSMN1; SMN2
SCHEMBL13779725 0.90 MAPK1 (0.44) MAPK1TSHRHIF1ATHRBSMN1; SMN2
SCHEMBL13423351 0.90 LMNA (0.46) MAPK1TSHRHIF1ATHRBSMN1; SMN2
SCHEMBL18492364 0.87 MAPK1 (0.49) MAPK1TSHRHIF1ATHRBKDM4E
SCHEMBL19456757 0.87 THRB (0.43) MAPK1TSHRHIF1ATHRBSMN1; SMN2
SCHEMBL18492271 0.87 ADRB2 (0.53) THRBSMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL18392498 0.86 TSHR (0.43) MAPK1TSHRHIF1ATHRBSMN1; SMN2
SCHEMBL19129048 0.84 SOD1 (0.43) MAPK1TSHRHIF1ATHRBKDM4E
SCHEMBL16647277 0.84 THRB (0.41) MAPK1TSHRHIF1ATHRBKDM4E

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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