SCHEMBL28858723

SCHEMBL28858723

CN/C(=C\C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL12680132 0.81
SCHEMBL12680133 0.81 KDM4E (0.32) KDM4ETSHR
SCHEMBL19451624 0.77
SCHEMBL14196645 0.77
SCHEMBL18811995 0.77
SCHEMBL4965460 0.77
SCHEMBL4965456 0.77
SCHEMBL2011134 0.77 TSHR (0.42) KDM4ETSHR
SCHEMBL2011129 0.77 TSHR (0.42) KDM4ETSHR
SCHEMBL2011132 0.77 TSHR (0.42) 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
CN-107941946-A Detection method of Vonoprazan fumarate 中山奕安泰医药科技有限公司 2018-04-20 CN disclosed