SCHEMBL27767460

SCHEMBL27767460

NCc1ccc(-c2cc(C(N)=O)c(N(N)C=O)[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 18/20 0.44
BRD4 O60885 1/20 0.39
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CCNA1 P78396 1/20 0.35
PLK4 O00444 1/20 0.34
CHEK1 O14757 1/20 0.34
DAPK3 O43293 1/20 0.34
PRKD3 O94806 1/20 0.34
MAP4K4 O95819 1/20 0.34
PAK4 O96013 1/20 0.34
ABL1 P00519 1/20 0.34
PRKCG P05129 1/20 0.34
FYN P06241 1/20 0.34
CSF1R P07333 1/20 0.34
LYN P07948 1/20 0.34
RET P07949 1/20 0.34
PDGFRB P09619 1/20 0.34
KIT P10721 1/20 0.34
SRC P12931 1/20 0.34

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
SCHEMBL27788872 0.90 CHUK (0.41) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27789089 0.89 CDC7 (0.45) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27788861 0.85 BRD4 (0.41) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27767416 0.84 CDC7 (0.52) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27767423 0.84 CDC7 (0.52) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27788862 0.84 BRD4 (0.56) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27788978 0.82 BRD4 (0.39) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27767429 0.82 CDC7 (0.45) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27767430 0.81 PARP1 (0.46) CDC7BRD4CCNA2CDK2CCNA1
SCHEMBL27767432 0.81 PARP10 (0.43) CDC7BRD4

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-101622229-B Pyrrole derivatives having ureido and aminocarbonyl groups as substituents SANTEN PHARMACEUTICAL CO LTD 2013-02-27 CN claimed
CN-101622229-A Novel pyrrole derivatives having ureido group and aminocarbonyl group as substituents SANTEN PHARMACEUTICAL CO LTD 2010-01-06 CN claimed
CN-101622229-B Pyrrole derivatives having ureido and aminocarbonyl groups as substituents SANTEN PHARMACEUTICAL CO LTD 2013-02-27 CN disclosed
CN-101622229-A Novel pyrrole derivatives having ureido group and aminocarbonyl group as substituents SANTEN PHARMACEUTICAL CO LTD 2010-01-06 CN disclosed