SCHEMBL20352139

SCHEMBL20352139

CN1CCC(O[C@H]2OC2N2CCN(c3ccc(Cl)c(NC(=O)c4coc(N)n4)c3)CC2)C1

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PAICS P22234 20/20 0.48

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
SCHEMBL21571658 0.86 PAICS (0.50) PAICS
SCHEMBL24220398 0.81 PAICS (0.61) PAICS
SCHEMBL20352088 0.81 PAICS (0.48) PAICS
SCHEMBL24220531 0.78 PAICS (0.54) PAICS
SCHEMBL20352164 0.78 PAICS (0.54) PAICS
SCHEMBL24220532 0.78 PAICS (0.55) PAICS
SCHEMBL20352036 0.77 PAICS (0.48) PAICS
SCHEMBL21571670 0.77 PAICS (0.46) PAICS
SCHEMBL28322401 0.76 PAICS (0.54) PAICS
SCHEMBL21575911 0.76 PAICS (0.47) 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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