SCHEMBL20913182

SCHEMBL20913182

COC(C)COC(C)c1c(C(=O)O)cnc2cc(Cl)nn12

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 20/20 0.45
▸ BIRC3 Q13489 1/20 0.39

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
SCHEMBL18787664 1.00 MALT1 (0.45) MALT1BIRC3
SCHEMBL18787663 1.00 MALT1 (0.45) MALT1BIRC3
SCHEMBL17293010 0.87 MALT1 (0.55) MALT1BIRC3
SCHEMBL17293012 0.87 MALT1 (0.55) MALT1BIRC3
SCHEMBL18787821 0.87 MALT1 (0.55) MALT1BIRC3
SCHEMBL18787735 0.86 MALT1 (0.55) MALT1
SCHEMBL18787710 0.86 MALT1 (0.55) MALT1
SCHEMBL18787711 0.86 MALT1 (0.55) MALT1
SCHEMBL20913179 0.82 MALT1 (0.45) MALT1BIRC3
SCHEMBL18787694 0.82 MALT1 (0.45) MALT1BIRC3

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
Send feedback