SCHEMBL6672255

SCHEMBL6672255

Nc1ncnc2c1ccn2COCCO

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
PNP P00491 1/20 0.40
TSHR P16473 1/20 0.40
EDNRA P25101 1/20 0.40
HTR2A P28223 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
HBB P68871 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SRC P12931 2/20 0.39
LCK P06239 1/20 0.39
TEK Q02763 1/20 0.39
ADORA2A P29274 2/20 0.39
ADORA1 P30542 1/20 0.39
PRMT5 O14744 4/20 0.39
WDR77 Q9BQA1 4/20 0.39
ADK P55263 1/20 0.39
ENPP1 P22413 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
SCHEMBL13738818 0.83 PRMT5 (0.40) PRMT5WDR77ADKENPP1
SCHEMBL29407693 0.83 PRMT5 (0.40) PRMT5WDR77ADKENPP1
SCHEMBL19993789 0.80 ADK (0.45) ADORA2AADORA1PRMT5WDR77ADK
SCHEMBL21367268 0.79 PRMT5 (0.47) ADORA2AADORA1PRMT5WDR77ADK
SCHEMBL2293269 0.75 ADORA2A (0.66) USP2PNPTSHREDNRAHTR2A
SCHEMBL13067510 0.75 PRMT5 (0.39) SRCADORA2APRMT5WDR77ADK
SCHEMBL24236880 0.75 ADK (0.46) TSHRHSD17B10ADORA2AADORA1PRMT5
SCHEMBL30336240 0.74 NSD3 (0.40) ADORA2AADORA1PRMT5WDR77
SCHEMBL30335860 0.74 PRMT5 (0.46) PRMT5WDR77
SCHEMBL12151781 0.73 ADORA2A (0.53) ADORA2AADORA1PRMT5WDR77ADK

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-2004037159-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING FAT METABOLISM OBETHERAPY BIOTECHNOLOGY (FR) 2004-05-06 WO disclosed