SCHEMBL20352103

SCHEMBL20352103

CNCC[S+]([O-])N1CCN(c2ccc(Cl)c(NC(=O)c3coc(N)n3)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PAICS P22234 20/20 0.53

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
SCHEMBL20352110 0.92 PAICS (0.55) PAICS
SCHEMBL24220537 0.91 PAICS (0.48) PAICS
SCHEMBL24220414 0.91 PAICS (0.52) PAICS
SCHEMBL24220480 0.87 PAICS (0.58) PAICS
SCHEMBL24220472 0.87 PAICS (0.58) PAICS
SCHEMBL20352153 0.86 PAICS (0.43) PAICS
SCHEMBL21571661 0.83 PAICS (0.53) PAICS
SCHEMBL24220398 0.82 PAICS (0.61) PAICS
SCHEMBL21571646 0.82 PAICS (0.53) PAICS
SCHEMBL24220491 0.82 PAICS (0.42) PAICS

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
WO-2018122549-A1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER LIFEARC (GB) 2018-07-05 — — WO disclosed
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