SCHEMBL1380771

SCHEMBL1380771

CCOc1cc(CN(c2nc3cccc(C(=O)Nc4nc(C)cs4)c3o2)C2CCNCC2)ccc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 2/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
MAPK10 P53779 1/20 0.41
GCK P35557 4/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
MITF O75030 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
REN P00797 1/20 0.36
HPGD P15428 2/20 0.36
RECQL P46063 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
SCHEMBL1378225 0.89 KMT2A (0.42) SMN1; SMN2LMNAKDM4EMAPK1MAPK10
SCHEMBL5478920 0.85 LMNA (0.40) LMNATP53MAPTMEN1KMT2A
SCHEMBL4866640 0.85 MAPT (0.41) SMN1; SMN2LMNAKDM4ETP53MAPT
SCHEMBL5483266 0.85 MAPT (0.46) SMN1; SMN2LMNAKDM4EMAPK1MAPK10
SCHEMBL5492474 0.84 POLB (0.42) SMN1; SMN2LMNAKDM4ETP53MAPT
SCHEMBL4593955 0.80 SSTR5 (0.39) LMNAKDM4ETP53MAPTREN
SCHEMBL5483270 0.80 KMT2A (0.44) SMN1; SMN2LMNAKDM4EMEN1KMT2A
SCHEMBL5486670 0.80 CETP (0.39) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL4593502 0.79 REN (0.39) SMN1; SMN2LMNAKDM4ETP53MAPT
SCHEMBL4594411 0.79 REN (0.43) TP53MAPTREN

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
JP-4708474-B2 2011-06-22 JP claimed