SCHEMBL22476543

SCHEMBL22476543

CNNCCOCCOCCOCCOCCOCCO

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
TSHR P16473 3/20 0.48
MAPK1 P28482 1/20 0.48
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 2/20 0.40
APP P05067 2/20 0.35
KCNH3 Q9ULD8 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
SCHEMBL22144663 0.94 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL21106327 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL849308 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16806576 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16806577 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL24376233 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL20548025 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL21069959 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL30380142 0.80 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL26068190 0.80 MEN1 (0.58) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3303366-B1 DERIVATIVES OF DOLASTATIN 10 AND USES THEREOF NEWBIO THERAPEUTICS INC (CN) 2020-09-30 EP disclosed