SCHEMBL28036576

SCHEMBL28036576

OCCC(O)c1ccccc1.[LiH].[LiH]

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.55
LMNA P02545 1/20 0.54
KDM4E B2RXH2 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TRPA1 O75762 1/20 0.48
AOC3 Q16853 5/20 0.48
HTR1A P08908 1/20 0.42
BCAT2 O15382 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL74830 0.98 RIPK1 (0.57) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL973028 0.98 RIPK1 (0.57) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL1464020 0.98 RIPK1 (0.57) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL27438778 0.95 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1TRPA1
Bromide SCHEMBL4251425 0.95 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL27848643 0.95 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL27769136 0.95 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL27721522 0.95 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL27373232 0.95 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1TRPA1
SCHEMBL27628749 0.95 RIPK1 (0.55) RIPK1LMNAKDM4EL3MBTL1TRPA1

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-105008459-A Polylactic resin composition, molded product, and method for producing polylactic resin composition TORAY INDUSTRIES 2015-10-28 CN disclosed