SCHEMBL28800271

SCHEMBL28800271

N#Cc1ccc2nc(CNC(=O)O)cn2c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 8/20 0.57
KDM4E B2RXH2 6/20 0.45
HPGD P15428 3/20 0.45
TP53 P04637 1/20 0.43
CSNK1D P48730 1/20 0.41
CSNK1G2 P78368 1/20 0.41
APP P05067 1/20 0.41
ALDH1A3 P47895 1/20 0.40
TSHR P16473 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 2/20 0.39
POLB P06746 1/20 0.39
LRRK2 Q5S007 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
SCHEMBL22530986 0.83 KDM4E (0.52) METTL3KDM4ETP53CSNK1DCSNK1G2
SCHEMBL15261502 0.82 KDM4E (0.63) METTL3KDM4ETP53CSNK1DCSNK1G2
SCHEMBL22499049 0.81 METTL3 (0.51) METTL3KDM4EHPGDTP53CSNK1D
SCHEMBL12618991 0.76 KDM4E (0.45) METTL3KDM4EHPGDCSNK1DCSNK1G2
SCHEMBL10311331 0.76 APP (0.50) METTL3KDM4ETP53CSNK1DCSNK1G2
SCHEMBL22499286 0.76 APP (0.47) METTL3KDM4ETP53CSNK1DCSNK1G2
SCHEMBL25774521 0.76 APP (0.47) METTL3KDM4ETP53CSNK1DCSNK1G2
SCHEMBL28800287 0.76 METTL3 (0.57) METTL3KDM4EHPGDTP53ALDH1A1
SCHEMBL1733873 0.75 PTGS1 (0.53) METTL3KDM4ECSNK1DCSNK1G2APP
SCHEMBL27030289 0.74 METTL3 (0.58) METTL3KDM4EHPGDALDH1A1HSD17B10

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
CN-113905787-A METTL3 inhibiting compounds 斯托姆治疗有限公司 2022-01-07 CN disclosed