SCHEMBL7524334

SCHEMBL7524334

COCCOCCOC(CCO)OCCOC

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CA2 P00918 1/20 0.33
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
MAPT P10636 1/20 0.30
GBA1 P04062 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
SCHEMBL25753064 1.00 MEN1 (0.36) MEN1KMT2ACA2TSHRMAPK1
SCHEMBL16907179 0.93 GBA1 (0.32) GBA1
SCHEMBL18251041 0.89 GBA1 (0.31) GBA1
SCHEMBL365792 0.82 CA2 (0.35) MEN1KMT2ACA2
SCHEMBL20067025 0.82 CA2 (0.35) MEN1KMT2ACA2
SCHEMBL4847179 0.81 MEN1 (0.35) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL29396142 0.81 MEN1 (0.35) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL13726589 0.80 CA2 (0.34) CA2TSHR
SCHEMBL9063024 0.79 TSHR (0.56) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL9657549 0.76 TSHR (0.57) 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-0718293-B1 CYCLODEPSIPEPTIDE COMPOUND FUJISAWA PHARMACEUTICAL CO (JP) 2002-03-13 EP disclosed