SCHEMBL27786274

SCHEMBL27786274

Cc1cc(Cc2ccccn2)c2c(n1)NC(C=O)N2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
KDM4E B2RXH2 5/20 0.41
TOP2A P11388 1/20 0.36
TOP2B Q02880 1/20 0.36
TSHR P16473 1/20 0.34
PNP P00491 1/20 0.34
KCNH2 Q12809 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 1/20 0.33
GSK3A P49840 3/20 0.32
GSK3B P49841 3/20 0.32
HRH3 Q9Y5N1 2/20 0.32
HRH4 Q9H3N8 1/20 0.32
RAB9A P51151 4/20 0.32
ALDH1A1 P00352 3/20 0.32
NPC1 O15118 3/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MCL1 Q07820 1/20 0.32

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
SCHEMBL3206704 0.69 KDM4E (0.46) MAPTKDM4ETOP2ATOP2BTSHR
SCHEMBL28343693 0.62 L3MBTL1 (0.53) MAPTTSHRHRH3HRH4ALDH1A1
SCHEMBL28132575 0.62 ALDH1A1 (0.43) MAPTKDM4ETSHRPNPHRH3
SCHEMBL31081656 0.62 KDM4E (0.49) MAPTKDM4EHRH3HRH4ALDH1A1
SCHEMBL21142100 0.62 KDM4E (0.49) MAPTKDM4EHRH3HRH4ALDH1A1
SCHEMBL27694256 0.61 L3MBTL1 (0.46) MAPTKDM4ETSHRKMT2AMEN1
SCHEMBL764538 0.60 GRM5 (0.49) HRH3HRH4ALDH1A1ASIC3
SCHEMBL21142103 0.60 KDM4E (0.48) MAPTKDM4EHRH3HRH4ALDH1A1
SCHEMBL14750985 0.60 ASIC3 (0.51) MAPTKDM4EKMT2AHRH3HRH4
SCHEMBL18738906 0.60 KDM4E (0.50) MAPTKDM4EKMT2AHRH3RAB9A

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
CN-101600715-A Compound with angiotensin-ii receptor antagonistic action and PPAR γ activating activities PFIZER PROD INC (US) 2009-12-09 CN disclosed