SCHEMBL27464429

SCHEMBL27464429

N#Cc1ccccc1-c1nc2cccc(C(N)=O)c2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 12/20 0.46
CDC7 O00311 1/20 0.46
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 1/20 0.43
CSNK1A1 P48729 2/20 0.43
DYRK1B Q9Y463 2/20 0.43
PLK4 O00444 1/20 0.43
CHEK1 O14757 1/20 0.43
AURKA O14965 1/20 0.43
DAPK3 O43293 1/20 0.43
MAP4K4 O95819 1/20 0.43
CSF1R P07333 1/20 0.43
RET P07949 1/20 0.43
FGFR1 P11362 1/20 0.43
PDGFRA P16234 1/20 0.43
LTK P29376 1/20 0.43
KDR P35968 1/20 0.43
MAP2K2 P36507 1/20 0.43
FLT3 P36888 1/20 0.43
PRKX P51817 1/20 0.43

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
SCHEMBL27461815 0.83 KDM4E (0.54) PARP1KDM4ERAB9ACSNK1A1DYRK1B
SCHEMBL8648025 0.79 PARP1 (0.67) PARP1CDC7FGFR1
SCHEMBL3579908 0.78 PARP1 (0.61) PARP1KDM4ERAB9APLK4MAP4K4
SCHEMBL17048129 0.77 KDM4E (0.56) PARP1KDM4ERAB9APLK4CHEK1
SCHEMBL6802033 0.75 FGFR1 (0.51) PARP1KDM4ERAB9AFGFR1
SCHEMBL27725567 0.74 KEAP1 (0.53) PARP1CDC7KDM4ERAB9A
SCHEMBL6800084 0.74 PARP1 (0.44) PARP1KDM4ERAB9ACSNK1A1DYRK1B
SCHEMBL6805509 0.74 PARP1 (0.53) PARP1CDC7KDM4ERAB9ADHODH
SCHEMBL6806431 0.73 PKN1 (0.42) PARP1KDM4ERAB9ACSNK1A1DYRK1B
SCHEMBL6804985 0.73 PLK4 (0.39) PARP1KDM4ERAB9ACSNK1A1DYRK1B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1159007-C Benzimidazole compounds ť��˹����ѧ����Ͷ�����޹�˾ 2004-07-28 CN claimed
CN-1195985-A Benzimidazole compounds UNIV NEWCASTLE VENTURES LTD (GB) 1998-10-14 CN claimed
CN-1159007-C Benzimidazole compounds ť��˹����ѧ����Ͷ�����޹�˾ 2004-07-28 CN disclosed
CN-1195985-A Benzimidazole compounds UNIV NEWCASTLE VENTURES LTD (GB) 1998-10-14 CN disclosed