SCHEMBL19787853

SCHEMBL19787853

C=C[C@H](C)OCNC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
HIF1A Q16665 1/20 0.32
MTNR1A P48039 3/20 0.32
MTNR1B P49286 3/20 0.32
TSHR P16473 3/20 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
SCHEMBL1828560 0.76
SCHEMBL11890489 0.72
SCHEMBL19821916 0.71 MTNR1A (0.37) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL30208805 0.69 CRBN (0.36) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL6962867 0.68
SCHEMBL18598077 0.68 BCHE (0.34) KDM4ETSHR
SCHEMBL10781738 0.67
SCHEMBL11365507 0.67 MGAM (0.38) TSHR
SCHEMBL12423988 0.67 TSHR (0.47) KDM4EMAPK1HIF1ATSHR
SCHEMBL30960337 0.67 TSHR (0.44) KDM4ETSHR

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-9873704-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2018-01-23 US disclosed