SCHEMBL27788872

SCHEMBL27788872

NC(=O)c1cc(-c2ccc(CO)cc2)[nH]c1N(N)C=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHUK O15111 2/20 0.41
IKBKB O14920 1/20 0.41
PARP1 P09874 2/20 0.40
BRD4 O60885 1/20 0.39
CDC7 O00311 13/20 0.39
RIPK1 Q13546 1/20 0.36
CSF1R P07333 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CCNA1 P78396 1/20 0.35
INSR P06213 1/20 0.34
MAPK8 P45983 1/20 0.34
CAMKK2 Q96RR4 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
SCHEMBL27767460 0.90 CDC7 (0.44) BRD4CDC7CSF1RCCNA2CDK2
SCHEMBL27789089 0.89 CDC7 (0.45) IKBKBBRD4CDC7CCNA2CDK2
SCHEMBL27767430 0.86 PARP1 (0.46) CHUKIKBKBPARP1BRD4CDC7
SCHEMBL27788861 0.85 BRD4 (0.41) PARP1BRD4CDC7CCNA2CDK2
SCHEMBL27767423 0.84 CDC7 (0.52) BRD4CDC7CCNA2CDK2CCNA1
SCHEMBL27767416 0.84 CDC7 (0.52) IKBKBBRD4CDC7CCNA2CDK2
SCHEMBL27788862 0.84 BRD4 (0.56) IKBKBBRD4CDC7CCNA2CDK2
SCHEMBL27788978 0.82 BRD4 (0.39) PARP1BRD4CDC7CCNA2CDK2
SCHEMBL27767429 0.82 CDC7 (0.45) PARP1BRD4CDC7CCNA2CDK2
SCHEMBL27767432 0.81 PARP10 (0.43) BRD4CDC7MAPK8

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 2 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 disclosed
CN-101622229-A Novel pyrrole derivatives having ureido group and aminocarbonyl group as substituents SANTEN PHARMACEUTICAL CO LTD 2010-01-06 CN disclosed