SCHEMBL6680

SCHEMBL6680

CCNC(=O)Oc1cc2cccc(Cl)c2nc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.36
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
ATM Q13315 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36

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
SCHEMBL1726583 0.82 SMN1; SMN2 (0.39) POLBKDM4EMEN1GAAMAPT
SCHEMBL9733 0.79 MEN1 (0.37) POLBKDM4EMEN1GAAMAPT
SCHEMBL1728693 0.78 KDM4E (0.38) POLBKDM4EMEN1GAAMAPT
SCHEMBL8073 0.76 KMT2A (0.36) POLBKDM4EMEN1GAAMAPT
SCHEMBL12014770 0.73 NQO2 (0.46) POLBKDM4EMEN1MAPTKMT2A
SCHEMBL28455249 0.71 GAA (0.50) POLBKDM4EMEN1GAAMAPT
SCHEMBL10751843 0.70 HSP90AA1 (0.63) POLBKDM4EMEN1GAAMAPT
SCHEMBL4191610 0.70 MAOB (0.40) POLBKDM4EMEN1GAAMAPT
SCHEMBL9952093 0.70 KDM4E (0.51) POLBKDM4EMEN1GAAMAPT
SCHEMBL14047560 0.70 DRD4 (0.44) KDM4EMEN1GAAMAPTKMT2A

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-2011058112-A1 FUSED BICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2011-05-19 WO disclosed