SCHEMBL29926486

SCHEMBL29926486

O[C@H](CCCl)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.55
LMNA P02545 1/20 0.54
KDM4E B2RXH2 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
AOC3 Q16853 5/20 0.48
HTR1A P08908 2/20 0.44
BCAT2 O15382 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
SCHEMBL525669 1.00 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL1142222 1.00 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL1200943 1.00 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL6574961 0.88 RIPK1 (0.53) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL2117353 0.88 RIPK1 (0.53) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL30716448 0.88 RIPK1 (0.53) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL5185803 0.85 RIPK1 (0.64) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL3081755 0.85 RIPK1 (0.64) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL11828179 0.82 RIPK1 (0.61) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL8710104 0.82 RIPK1 (0.61) RIPK1LMNAKDM4EL3MBTL1AOC3

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-110385108-B Chiral covalent organic framework composite membrane and preparation method and application thereof 中山大学 2022-11-04 CN claimed