SCHEMBL4746265

SCHEMBL4746265

CN(C)CCCn1c(=O)nc2n(-c3ccc(F)cc3)c3cc(Cl)ccc3nc-2c1=O

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSR P00390 7/20 0.61
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
MAT2A P31153 2/20 0.38
MPO P05164 2/20 0.38
XDH P47989 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL4743788 0.91 GSR (0.51) GSRKDM4EALDH1A1HPGDMAT2A
SCHEMBL4743737 0.86 GSR (0.48) GSRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL4747828 0.86 GSR (0.45) GSRKDM4EALDH1A1HPGDMAT2A
SCHEMBL4743759 0.85 MPO (0.43) GSRKDM4EALDH1A1HPGDMAT2A
SCHEMBL4743742 0.79 GSR (0.42) GSRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL4748220 0.79 GSR (0.48) GSRKDM4EALDH1A1HPGD
SCHEMBL4744200 0.77 GSR (0.46) GSRKDM4EALDH1A1HPGD
SCHEMBL4748253 0.75 GSR (0.48) GSRKDM4EALDH1A1HPGD
SCHEMBL4747565 0.75 GSR (0.48) GSRKDM4EALDH1A1HPGDMAT2A
SCHEMBL4744199 0.75 KCNH2 (0.48) GSRKDM4EALDH1A1HPGD

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