SCHEMBL29636334

SCHEMBL29636334

O=C1C=CCCCCCCCCN1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
FKBP5 Q13451 1/20 0.36
CRBN Q96SW2 1/20 0.36
KDM4E B2RXH2 2/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
OR51E2 Q9H255 1/20 0.32
CA1 P00915 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL4954673 1.00 ALDH1A1 (0.39) ALDH1A1FKBP5CRBNKDM4EGAA
SCHEMBL30545269 1.00 ALDH1A1 (0.39) ALDH1A1FKBP5CRBNKDM4EGAA
SCHEMBL4954670 1.00 ALDH1A1 (0.39) ALDH1A1FKBP5CRBNKDM4EGAA
SCHEMBL4954677 1.00 ALDH1A1 (0.39) ALDH1A1FKBP5CRBNKDM4EGAA
SCHEMBL541181 0.98
SCHEMBL541182 0.98
SCHEMBL651905 0.91
5,6-Dihydro-2(1H)-Pyridinone SCHEMBL49488 0.80
5,6-Dihydro-2(1H)-Pyridinone SCHEMBL9464948 0.78
5,6-Dihydro-2(1H)-Pyridinone SCHEMBL31482438 0.78

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115175581-A Core-sheath composite fiber for artificial hair, head ornament comprising same, and method for producing same 株式会社钟化 2022-10-11 CN disclosed
CN-114569495-A Resin particle 富士胶片商业创新有限公司 2022-06-03 CN disclosed