SCHEMBL20913178

SCHEMBL20913178

C[C@H](C=O)c1c(C(=O)OC(C)(C)C)cnc2cc(Cl)nn12

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 20/20 0.41
▸ BIRC3 Q13489 1/20 0.36

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
SCHEMBL17293034 0.85 MALT1 (0.51) MALT1BIRC3
SCHEMBL17293032 0.85 MALT1 (0.51) MALT1BIRC3
SCHEMBL17293107 0.83 MALT1 (0.50) MALT1BIRC3
SCHEMBL17293109 0.83 MALT1 (0.50) MALT1BIRC3
SCHEMBL17293104 0.82 MALT1 (0.57) MALT1BIRC3
SCHEMBL17293103 0.82 MALT1 (0.57) MALT1BIRC3
SCHEMBL18839537 0.76 MALT1 (0.39) MALT1BIRC3
SCHEMBL22408849 0.76 MALT1 (0.39) MALT1BIRC3
SCHEMBL18839535 0.76 MALT1 (0.39) MALT1BIRC3
SCHEMBL22408834 0.74 MALT1 (0.40) MALT1

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-3149001-B1 NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES AND THEIR USE AS MALT1 INHIBITORS NOVARTIS AG (CH) 2019-04-24 — — EP disclosed
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