SCHEMBL23986913

SCHEMBL23986913

C/C=C\C(=N/O)c1nc2c(c(N(C)CC(=O)NC(C)(C)C)n1)CCC2

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1A2 P05177 1/20 0.31
GAA P10253 1/20 0.31
USP2 O75604 1/20 0.31
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 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
SCHEMBL23986758 0.82 MEN1 (0.34) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL25932387 0.80 POLB (0.38) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL30225306 0.79 POLB (0.37) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL30225307 0.79 POLB (0.37) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL27209476 0.79 POLB (0.37) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL23975804 0.79 POLB (0.37) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL23976467 0.79 POLB (0.36) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL23986932 0.77 MEN1 (0.35) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL30225189 0.77 POLB (0.40) MEN1POLBKMT2ACYP1A2GAA
SCHEMBL23975730 0.77 POLB (0.40) MEN1POLBKMT2ACYP1A2GAA

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-2021222363-A1 CYCLOALKYL PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2021-11-04 WO disclosed