SCHEMBL24784170

SCHEMBL24784170

CC(C)(CC(C)(C)C(=O)O)OC1CCCCO1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ACACB O00763 1/20 0.32
SLC6A3 Q01959 2/20 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
SCHEMBL24784171 0.80 MEN1 (0.30) MEN1KMT2A
SCHEMBL12262230 0.80 ACACB (0.32) MEN1KMT2AACACB
SCHEMBL3618302 0.78 MEN1 (0.38) MEN1KMT2ASLC6A3
SCHEMBL1114731 0.78 MEN1 (0.44) MEN1KMT2ASLC6A3
SCHEMBL13983432 0.77
SCHEMBL1024731 0.76 MEN1 (0.33) MEN1KMT2A
SCHEMBL8374252 0.76 MEN1 (0.40) MEN1KMT2ASLC6A3
SCHEMBL29005522 0.76 MEN1 (0.40) MEN1KMT2ASLC6A3
SCHEMBL16265344 0.74 ALDH1A1 (0.36) MEN1KMT2A
SCHEMBL30510318 0.74 MEN1 (0.36) MEN1KMT2AACACB

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
WO-2022265178-A1 TRAP1 INHIBITOR AND USE THEREOF 주식회사 스마틴바이오 2022-12-22 WO disclosed