SCHEMBL16005391

SCHEMBL16005391

COC(N)COCCOCCOCCOCCOCCO

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 2/20 0.43
MAPK1 P28482 1/20 0.43
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL16005286 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16005406 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL14801943 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16005383 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL28455706 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16005645 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL6554079 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL2955801 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL515809 0.96
SCHEMBL4887517 0.80 MEN1 (0.41) MEN1KMT2ATSHRMAPK1THRB

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
EP-2774915-A1 New derivatives of resveratrol Mattarei, Andrea (IT) 2014-09-10 EP claimed
EP-2774915-A1 New derivatives of resveratrol Mattarei, Andrea (IT) 2014-09-10 EP disclosed