SCHEMBL24220536

SCHEMBL24220536

CN(C)CC[S+]([O-])N1CCN(c2ccc(Br)c(NC(=O)c3coc(N)n3)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PAICS P22234 20/20 0.43

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
SCHEMBL20352153 0.88 PAICS (0.43) PAICS
SCHEMBL20352062 0.87 PAICS (0.38) PAICS
SCHEMBL24220491 0.87 PAICS (0.42) PAICS
SCHEMBL20352120 0.84 PAICS (0.49) PAICS
SCHEMBL20352137 0.83 PAICS (0.43) PAICS
SCHEMBL20352094 0.83 PAICS (0.37) PAICS
SCHEMBL20352021 0.83 PAICS (0.48) PAICS
SCHEMBL24220473 0.82 PAICS (0.38) PAICS
SCHEMBL24220529 0.82 PAICS (0.49) PAICS
SCHEMBL20352066 0.82 PAICS (0.45) 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
EP-3562824-B1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER LIFEARC (GB) 2022-01-26 — — EP disclosed
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