SCHEMBL29237478

SCHEMBL29237478

CCOC(=O)CCc1cccc(Cc2cccn2C(=O)OC(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
CYP4F2 P78329 2/20 0.40
CYP4A11 Q02928 2/20 0.40
SYK P43405 4/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
P2RY12 Q9H244 1/20 0.36
PPARG P37231 2/20 0.35
PPARA Q07869 2/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
TBXAS1 P24557 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP4Z1 Q86W10 1/20 0.34
NR1H2 P55055 1/20 0.34
ALOX5 P09917 1/20 0.33

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
SCHEMBL30967908 1.00 L3MBTL1 (0.42) L3MBTL1CYP4F2CYP4A11SYKPDE3B
SCHEMBL29237420 0.81 TTR (0.42) L3MBTL1ALOX5
SCHEMBL29237424 0.81 TTR (0.42) L3MBTL1ALOX5
SCHEMBL30217202 0.81 TTR (0.42) L3MBTL1ALOX5
SCHEMBL30967928 0.78 CTSB (0.40) HSP90AA1HSP90AB1NR1H2
SCHEMBL30967884 0.78 CTSB (0.40) HSP90AA1HSP90AB1NR1H2
SCHEMBL4425984 0.76 CYP4F2 (0.64) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL23792059 0.76 L3MBTL1 (0.45) L3MBTL1HSP90AA1HSP90AB1
SCHEMBL2628927 0.72 HSP90AA1 (0.44) L3MBTL1HSP90AA1HSP90AB1NR1H2
SCHEMBL13104077 0.72 CYP4F2 (0.58) L3MBTL1CYP4F2CYP4A11SYKPDE3B

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-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 CN disclosed