SCHEMBL28111386

SCHEMBL28111386

CCC(C)C1(O)CCCO1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 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
SCHEMBL17082318 0.77 CA1 (0.34)
SCHEMBL28428252 0.73
SCHEMBL15108060 0.72
SCHEMBL3806857 0.67
SCHEMBL13550809 0.67
SCHEMBL11462995 0.67
SCHEMBL26860298 0.66 TSHR (0.32)
SCHEMBL25275705 0.65
SCHEMBL21030979 0.65
SCHEMBL12073570 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106045833-A Preparation method of 5-methyl-2-heptylene-4-one 广西大学 2016-10-26 CN claimed
CN-106045833-A Preparation method of 5-methyl-2-heptylene-4-one 广西大学 2016-10-26 CN disclosed
CN-106045833-A Preparation method of 5-methyl-2-heptylene-4-one 广西大学 2016-10-26 CN disclosed