SCHEMBL11507282

SCHEMBL11507282

CCCCNC(=O)N[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 7/20 0.61
▸ GAA P10253 1/20 0.60
▸ EPHX2 P34913 2/20 0.51

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
SCHEMBL11508796 0.91 PYGB (0.64) PYGBGAA
SCHEMBL11507426 0.85 PYGB (0.67) PYGBGAA
SCHEMBL11147300 0.83 PYGB (0.54) PYGBGAAEPHX2
SCHEMBL11508154 0.82 PYGB (0.68) PYGBGAA
SCHEMBL11506299 0.82 PYGB (0.68) PYGBGAA
SCHEMBL11507536 0.82 PYGB (0.68) PYGBGAA
SCHEMBL30957909 0.81 PYGB (0.69) PYGBGAA
SCHEMBL11424984 0.81 PYGB (0.65) PYGBGAA
SCHEMBL5467471 0.79 PYGB (0.51) PYGBGAA
SCHEMBL5838288 0.79 PYGB (0.51) PYGBGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4180655-A ANTITUMOR AND ANTILEUKEMIA AGENTS Suami, Tetsuo (JP) 1979-12-25 — — US disclosed
US-4086415-A ANTILEUKEMIA, ANTITUMOR Suami, Tetsuo (JA) 1978-04-25 — — US disclosed
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