SCHEMBL30132060

SCHEMBL30132060

CN(CC(=O)N1Cc2ccccc2C1)Cc1nc2ccccc2c(=O)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
ALPL P05186 1/20 0.60
ALPI P09923 1/20 0.60
ALDH1A1 P00352 6/20 0.59
MEN1 O00255 1/20 0.55
LMNA P02545 2/20 0.54
KDM4E B2RXH2 4/20 0.54
HTT P42858 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
TDP1 Q9NUW8 3/20 0.53
MDM2 Q00987 1/20 0.53
HSD17B10 Q99714 2/20 0.52
ESR1 P03372 1/20 0.52
POLB P06746 1/20 0.52
APEX1 P27695 1/20 0.52
BLM P54132 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
KCNH2 Q12809 1/20 0.50
MAPT P10636 1/20 0.49
ALOX15 P16050 1/20 0.49

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
SCHEMBL26096345 0.88 KMT2A (0.47) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL26097137 0.88 KMT2A (0.47) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL30132053 0.82 TNKS (0.42) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL23723707 0.82 TNKS (0.42) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL23723624 0.81 SPR (0.49) KMT2AALPLALPIALDH1A1LMNA
SCHEMBL23749976 0.81 PARP1 (0.61) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL23749827 0.78 KMT2A (0.65) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL30120622 0.78 KMT2A (0.65) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL23723685 0.77 PDE5A (0.41) KMT2AALPLALPIALDH1A1MEN1
SCHEMBL4602302 0.76 ALDH1A1 (0.69) KMT2AALPLALPIALDH1A1MEN1

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
EP-4100015-A1 COMBINATION THERAPY FOR TREATING MPS1 Gain Therapeutics SA (CH) 2022-12-14 EP disclosed