SCHEMBL5199528

SCHEMBL5199528

Cc1[nH]c2cc(F)ccc2c1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 1/20 0.50
CDK1 P06493 1/20 0.50
CCNB1 P14635 1/20 0.50
CCNA2 P20248 1/20 0.50
CDK2 P24941 1/20 0.50
CCNA1 P78396 1/20 0.50
CDK5 Q00535 1/20 0.50
CDK5R1 Q15078 1/20 0.50
CCNB3 Q8WWL7 1/20 0.50
KIF11 P52732 1/20 0.47
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
PARP1 P09874 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GPR84 Q9NQS5 1/20 0.42
FEN1 P39748 1/20 0.41
TNKS2 Q9H2K2 1/20 0.40
DAO P14920 1/20 0.40
PTGS1 P23219 7/20 0.40
PTGS2 P35354 7/20 0.40

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
SCHEMBL1708096 0.85 KIF11 (0.51) KIF11KMT2AKDM4EGPR84FEN1
SCHEMBL19481419 0.80 AHR (0.52) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL18949683 0.78 KIF11 (0.49) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL17027154 0.77 KIF11 (0.57) KIF11
SCHEMBL21082250 0.74 PTGS1 (0.53) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL21082251 0.74 MEN1 (0.58) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL29507671 0.74 KIF11 (0.61) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL1517851 0.74 KIF11 (0.61) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL28300274 0.73 CCNB2 (0.46) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL23369904 0.72 KIF11 (0.82) CCNB2CDK1CCNB1CCNA2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1829872-B1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS NISSAN CHEMICAL IND LTD (JP) 2015-07-29 EP claimed
EP-1829872-A1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS Nissan Chemical Industries, Ltd. (JP) 2007-09-05 EP claimed
EP-1829872-B1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS NISSAN CHEMICAL IND LTD (JP) 2015-07-29 EP disclosed
CN-101468964-B Processes for producing indole compound NISSAN CHEMICAL IND LTD 2011-05-11 CN disclosed
CN-100577659-C Processes for producing indole compound NISSAN CHEMICAL IND LTD 2010-01-06 CN disclosed
CN-101468964-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2009-07-01 CN disclosed
EP-1829872-A1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS Nissan Chemical Industries, Ltd. (JP) 2007-09-05 EP disclosed
CN-1896075-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2007-01-17 CN disclosed
CN-1286832-C Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2006-11-29 CN disclosed
CN-1646522-A Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2005-07-27 CN disclosed