SCHEMBL4747745

SCHEMBL4747745

CN(C)CCCn1c2nc(=O)[nH]c(=O)c-2nc2ccc(Cl)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
USP2 O75604 4/20 0.48
RXFP1 Q9HBX9 2/20 0.48
ALPL P05186 1/20 0.48
POLB P06746 1/20 0.48
ALPI P09923 1/20 0.48
ALPG P10696 1/20 0.48
AGTR1 P30556 1/20 0.48
MAPT P10636 3/20 0.47
KDM4E B2RXH2 3/20 0.47
HTT P42858 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
IDO1 P14902 1/20 0.47
CASP7 P55210 3/20 0.46
TDP2 O95551 3/20 0.46
NSD2 O96028 1/20 0.46
CASP3 P42574 1/20 0.46
CASP6 P55212 1/20 0.46
HAT1 O14929 3/20 0.46

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
SCHEMBL4743759 0.83 MPO (0.43) KDM4EMPOXDHRPS6KA3RPS6KA2
SCHEMBL1050380 0.82 TMEM97 (0.47) MEN1KMT2AUSP2RXFP1ALPL
SCHEMBL12287118 0.79 MEN1 (0.45) MEN1KMT2AUSP2RXFP1ALPL
SCHEMBL4748217 0.79 TDP2 (0.62) MEN1KMT2AUSP2RXFP1ALPL
SCHEMBL15901239 0.78 MEN1 (0.67) MEN1KMT2AUSP2RXFP1ALPL
SCHEMBL13496383 0.77 MEN1 (0.61) MEN1KMT2AUSP2RXFP1ALPL
SCHEMBL12287155 0.76 HAT1 (0.46) MEN1KMT2AUSP2RXFP1ALPL
SCHEMBL1965168 0.76 CFTR (0.52) KDM4EMPOXDHALDH1A1HPGD
SCHEMBL12286897 0.76 MEN1 (0.47) MEN1KMT2AUSP2RXFP1ALPL
SCHEMBL12286957 0.76 MEN1 (0.59) MEN1KMT2AUSP2RXFP1ALPL

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
WO-2008114009-A1 10H-BENZO(G)PTERDINE-2,4-DIONE COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CAMBRIDGE ENTERPRISE LTD. (GB) 2008-09-25 WO disclosed
WO-2008114009-A1 10H-BENZO(G)PTERDINE-2,4-DIONE COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CAMBRIDGE ENTERPRISE LTD. (GB) 2008-09-25 WO disclosed