SCHEMBL8638776

SCHEMBL8638776

O=C(O)CNNC(=O)CO

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.35
SRR Q9GZT4 1/20 0.35
EGLN1 Q9GZT9 3/20 0.32
KDM4E B2RXH2 2/20 0.32
KDM5C P41229 2/20 0.32
PHF8 Q9UPP1 2/20 0.32
KDM2A Q9Y2K7 2/20 0.32
CTH P32929 1/20 0.32
KDM6B O15054 1/20 0.31
FOLH1 Q04609 1/20 0.31
OR51E2 Q9H255 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
PTGS2 P35354 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL29162925 0.79 ALDH1A1 (0.32) LDHASRREGLN1KDM4EKDM5C
SCHEMBL28799538 0.79 FFAR3 (0.43) LDHASRREGLN1KDM4EKDM5C
SCHEMBL30441811 0.79 TSHR (0.43) LDHASRREGLN1KDM4EKDM5C
SCHEMBL170662 0.76
SCHEMBL3981769 0.75 HDAC3 (0.46) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL8352247 0.75 LDHA (0.50) LDHASRREGLN1KDM4EKDM5C
SCHEMBL7108066 0.75 OR51E2 (0.33) LDHASRROR51E2
SCHEMBL3051875 0.74
SCHEMBL7396316 0.74 ECE1 (0.41) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL21635548 0.74 GRIK1 (0.30)

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
US-5807983-A HUMAN GONADOTROPIN RELEASING HORMONE THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1998-09-15 US disclosed