SCHEMBL30225239

SCHEMBL30225239

[2H]C([2H])([2H])N(CC(=O)NC(C)(C)C)c1nc(-c2cc(OCC(C)(C)OC3CCCCO3)ccn2)nc2c1CCC2

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 3/20 0.33
SLC2A3 P11169 3/20 0.33
ACACB O00763 1/20 0.32
CNR2 P34972 1/20 0.31
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
RECQL P46063 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 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
SCHEMBL23976502 0.95 SLC2A1 (0.34) SLC2A1SLC2A3ACACBCNR2GAA
SCHEMBL23975995 0.88 ACACB (0.36) SLC2A1SLC2A3ACACB
SCHEMBL30225254 0.88 ACACB (0.36) SLC2A1SLC2A3ACACB
SCHEMBL24702214 0.87 SLC2A1 (0.31) SLC2A1SLC2A3ACACB
SCHEMBL24702435 0.86 SLC2A1 (0.30) SLC2A1SLC2A3
SCHEMBL30118830 0.86 MEN1 (0.35) SLC2A1SLC2A3GAAMAPK1RECQL
SCHEMBL23975778 0.84 MEN1 (0.37) SLC2A1SLC2A3CNR2GAAMAPK1
SCHEMBL30118714 0.84 MEN1 (0.37) SLC2A1SLC2A3CNR2GAAMAPK1
SCHEMBL23976164 0.84 ACACB (0.32) ACACBCNR2GAAMAPK1RECQL
SCHEMBL23976160 0.84 ACACB (0.32) ACACBCNR2GAAMAPK1RECQL

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
EP-4142732-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS Global Blood Therapeutics, Inc. (US) 2023-03-08 EP disclosed
EP-4143178-A1 CYCLOALKYL PYRIMIDINES AS FERROPORTIN INHIBITORS Global Blood Therapeutics, Inc. (US) 2023-03-08 EP disclosed