SCHEMBL28945565

SCHEMBL28945565

CC(C)C#CC(C)(O)CCC(C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL5179300 0.88
SCHEMBL125579 0.86 MEN1 (0.36) MEN1CYP3A4ALOX15KMT2A
SCHEMBL28044226 0.80 MEN1 (0.33) MEN1CYP3A4ALOX15KMT2A
SCHEMBL28654262 0.80 MEN1 (0.33) MEN1CYP3A4ALOX15KMT2A
SCHEMBL28389240 0.77 MEN1 (0.31) MEN1CYP3A4ALOX15KMT2A
Oxirane SCHEMBL20489350 0.77 ALDH1A1 (0.33) MEN1CYP3A4ALOX15KMT2A
SCHEMBL28964077 0.75
SCHEMBL12590721 0.75
SCHEMBL6901849 0.74 MEN1 (0.33) MEN1CYP3A4ALOX15KMT2A
SCHEMBL487775 0.73 MEN1 (0.34) MEN1CYP3A4ALOX15KMT2A

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-115516060-A Thermal interface material and method of use 汉高股份有限及两合公司 2022-12-23 CN disclosed