SCHEMBL8407499

SCHEMBL8407499

CC1(C)CC(=O)CC(C)(C)N1OC1CCCCN1[O]

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL50737 0.77
SCHEMBL646063 0.75 GAA (0.36) GAAMEN1KMT2A
SCHEMBL6813743 0.66 GAA (0.35) GAAMEN1KMT2A
SCHEMBL1527711 0.64 GAA (0.36) GAAMEN1KMT2A
SCHEMBL647198 0.63 GAA (0.43) GAAMEN1KMT2A
SCHEMBL18653504 0.63
SCHEMBL2019127 0.62 GAA (0.35) GAAMEN1KMT2A
SCHEMBL7462351 0.60 GAA (0.38) GAAMEN1KMT2A
SCHEMBL8368650 0.60
SCHEMBL50791 0.60 GAA (0.39) GAAMEN1KMT2A

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
JP-11043449-A None JP disclosed
JP-H1143449-A PREVENTION OF CONTAMINATION IN OLEFIN PRODUCTION OR PURIFICATION PROCESS HAKUTO CO LTD 1999-02-16 JP disclosed