SCHEMBL24220495

SCHEMBL24220495

C=CCCS(=O)(=O)N1CCN(c2ccc(I)c(NC(=O)c3coc(N)n3)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PAICS P22234 17/20 0.39
▸ POLB P06746 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34

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
SCHEMBL20352042 0.88 PAICS (0.40) PAICSKCNH2
SCHEMBL21571638 0.81 PAICS (0.50) PAICS
SCHEMBL20339077 0.80 PAICS (0.49) PAICS
SCHEMBL20339064 0.79 PAICS (0.39) PAICSKCNH2
SCHEMBL21571661 0.79 PAICS (0.53) PAICS
SCHEMBL21571640 0.79 PAICS (0.42) PAICSPOLB
SCHEMBL21571657 0.79 PAICS (0.53) PAICS
SCHEMBL20352101 0.79 PAICS (0.49) PAICS
SCHEMBL20352118 0.79 PAICS (0.54) PAICSKCNH2
SCHEMBL21571645 0.78 PAICS (0.55) 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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