SCHEMBL23317022

SCHEMBL23317022

CNNC(=O)CN(CC(N)=O)CC(N)=O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
KDM5C P41229 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
PHF8 Q9UPP1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL23316907 0.82 MCL1 (0.34)
SCHEMBL19841461 0.82 MCL1 (0.34)
SCHEMBL3749558 0.75 TDP1 (0.41) KDM4E
SCHEMBL23587946 0.75 CTSD (0.35) KDM4EKDM5CPHF8KDM2A
SCHEMBL23316914 0.75 HTR7 (0.31)
SCHEMBL23316908 0.74 MCL1 (0.39) CA1CA2
SCHEMBL19841408 0.74
Hydrochloric Acid SCHEMBL5872402 0.72 TDP1 (0.39) KDM4E
SCHEMBL29137898 0.72 TDP1 (0.39) KDM4E
SCHEMBL25933209 0.72

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-3052134-B1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME (US) 2021-05-05 EP disclosed