SCHEMBL8846572

SCHEMBL8846572

CCC(C)OC(=O)C(O)CCC#N

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.34
SLC1A2 P43004 1/20 0.32
FAAH O00519 1/20 0.31
CTSK P43235 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
SCHEMBL7055828 0.81 SLC1A2 (0.38) TSHRMEN1KMT2AMAPTSLC1A2
SCHEMBL1260192 0.78 MEN1 (0.47) TSHRMEN1KMT2AMAPTSLC1A2
SCHEMBL28355468 0.77 MAPT (0.41) TSHRMAPTFAAH
SCHEMBL10925106 0.77 MAPT (0.35) TSHRMEN1KMT2AMAPTSLC1A2
SCHEMBL8846299 0.77 MAPT (0.36) TSHRMAPTFAAH
SCHEMBL8846495 0.77 MAPT (0.36) TSHRMAPTFAAH
SCHEMBL8846589 0.77 FAAH (0.37) TSHRMAPTFAAH
SCHEMBL15153946 0.75 TET2 (0.47) MAPTFAAH
SCHEMBL15154020 0.72 FFAR4 (0.40) TSHRMEN1KMT2AMAPT
SCHEMBL11437493 0.72 MAPT (0.38) TSHRMAPTFAAHCTSK

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
EP-0467132-B1 4-Substituted-2-hydroxybutanoates and a process for producing them CHISSO CORP (JP) 1997-01-22 EP disclosed
US-5324852-A Ring opening optically active a-hydroxybutyrolactone; esterification CHISSO CORPORATION (JP) 1994-06-28 US disclosed
EP-0467132-A2 4-Substituted-2-hydroxybutanoates and a process for producing them CHISSO CORPORATION (JP) 1992-01-22 EP disclosed