SCHEMBL29588786

SCHEMBL29588786

OCC(O)c1ccccc1.[Na]

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
KDM4E B2RXH2 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
AOC3 Q16853 5/20 0.52
RIPK1 Q13546 1/20 0.48
BCAT2 O15382 1/20 0.45
TRPA1 O75762 2/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.42

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
SCHEMBL24750 0.97 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL30957022 0.97 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL3413766 0.97 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL1947849 0.97 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL8366350 0.97 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL18813398 0.95 LMNA (0.58) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL27887405 0.95 LMNA (0.58) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL9153590 0.95 LMNA (0.58) LMNAKDM4EL3MBTL1AOC3RIPK1
Bicarbonate SCHEMBL2836236 0.90 LMNA (0.54) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL1100967 0.90 LMNA (0.54) LMNAKDM4EL3MBTL1AOC3RIPK1

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
CN-112382788-B Single-ion conductive polymer electrolyte and preparation method and application thereof 合肥国轩高科动力能源有限公司 2022-04-12 CN disclosed