SCHEMBL24869713

SCHEMBL24869713

CN1CCc2cc(O)c(N)cc2C1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 8/20 0.69
DRD2 P14416 6/20 0.69
DRD5 P21918 6/20 0.69
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
PKM P14618 1/20 0.55
KMT2A Q03164 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MAOA P21397 4/20 0.51
MAOB P27338 4/20 0.51
SLC6A4 P31645 1/20 0.51
DRD4 P21917 3/20 0.50
DRD3 P35462 4/20 0.45

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
SCHEMBL2569339 0.93 DRD1 (0.73) DRD1DRD2DRD5KDM4EMEN1
SCHEMBL6247473 0.87 DRD2 (0.62) DRD1DRD2DRD5MAOAMAOB
SCHEMBL30897518 0.87 ALDH1A1 (0.54) DRD1DRD2DRD5KDM4EMEN1
Bromide SCHEMBL20854693 0.85 DRD2 (0.66) DRD1DRD2DRD5KDM4EMAPT
SCHEMBL24073822 0.80 MAOA (0.53) DRD1DRD2DRD5MAOAMAOB
SCHEMBL25557887 0.80 MAOA (0.53) DRD1DRD2DRD5MAOAMAOB
SCHEMBL31260373 0.79 MAOA (0.51) DRD1DRD2DRD5MAOAMAOB
SCHEMBL29573217 0.79 MAOA (0.51) DRD1DRD2DRD5MAOAMAOB
SCHEMBL29572411 0.79 MAOA (0.51) DRD1DRD2DRD5MAOAMAOB
SCHEMBL12826670 0.79 MAOA (0.51) DRD1DRD2DRD5MAOAMAOB

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-2023281417-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALTY S.A. (CH) 2023-01-12 WO disclosed