SCHEMBL28836833

SCHEMBL28836833

CCC(=O)C(C)(N)C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.40
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA7 P43166 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL27747511 0.81 DGAT1 (0.50) DGAT1CA1
SCHEMBL27820854 0.80 DGAT1 (0.37) DGAT1
SCHEMBL8837534 0.78
SCHEMBL28303089 0.77 FAAH (0.47)
SCHEMBL27328998 0.77 DGAT1 (0.54) DGAT1CA12CA1CA7CA14
SCHEMBL20503363 0.76 DGAT1 (0.35) DGAT1
SCHEMBL1486198 0.75 DGAT1 (0.44) DGAT1CA1
SCHEMBL28714854 0.75 DGAT1 (0.44) DGAT1
SCHEMBL29908023 0.75 DGAT1 (0.44) DGAT1
SCHEMBL27859821 0.75 DGAT1 (0.44) DGAT1CA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106170489-B New Pyrazolopyrimidine derivative and its purposes as MALT1 inhibitor 诺华股份有限公司 2019-05-03 CN disclosed
CN-106170489-A New Pyrazolopyrimidine derivative and the purposes as MALT1 inhibitor thereof 诺华股份有限公司 2016-11-30 CN disclosed