SCHEMBL29767333

SCHEMBL29767333

COCCNc1nc2nc[nH]c2c(=O)[nH]1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 3/20 0.70
▸ GDA Q9Y2T3 1/20 0.56
▸ LMNA P02545 1/20 0.52
▸ HTT P42858 1/20 0.52

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
SCHEMBL5935074 0.87 XDH (0.78) XDHGDA
SCHEMBL2343363 0.86 XDH (0.65) XDHGDA
SCHEMBL667798 0.85 XDH (0.84) XDHGDA
SCHEMBL2346371 0.83 XDH (0.62) XDHGDA
SCHEMBL216788 0.83 XDH (0.58) XDHGDA
SCHEMBL6272738 0.82 XDH (1.00) XDHGDA
SCHEMBL15545151 0.82 XDH (0.57) XDHGDA
SCHEMBL9806979 0.82 XDH (0.71) XDHGDA
SCHEMBL6751934 0.82 XDH (0.71) XDHGDA
SCHEMBL441799 0.82 XDH (0.71) XDHGDA

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-114729355-A PPM1A inhibitors and methods of using the same 奎里斯公司 2022-07-08 — — CN disclosed
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