SCHEMBL18768617

SCHEMBL18768617

CCNNc1cccc2cccc(S(=O)(=O)O)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.56
FABP4 P15090 1/20 0.56
CCNA2 P20248 1/20 0.56
CDK2 P24941 1/20 0.56
MAPK14 Q16539 1/20 0.56
NR4A1 P22736 1/20 0.55
CD40 P25942 3/20 0.44
CD40LG P29965 3/20 0.44
HSD17B10 Q99714 3/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
HIF1A Q16665 1/20 0.38
SNCA P37840 2/20 0.37
CHAT P28329 1/20 0.37
CASP6 P55212 1/20 0.37
TSHR P16473 1/20 0.35
MYC P01106 1/20 0.34
FABP1 P07148 1/20 0.34
KDM4E B2RXH2 2/20 0.33
UQCRB P14927 1/20 0.33

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
SCHEMBL27459951 0.84 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL18769044 0.83 TTR (0.60) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL23178061 0.79 TTR (0.64) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL21725437 0.76 TTR (0.60) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6911279 0.76 TTR (0.64) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL11759224 0.75 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6363338 0.74 LMNA (0.52) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL1742117 0.74 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6214963 0.73 TTR (0.68) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL8514648 0.73 TTR (0.56) TTRFABP4CCNA2CDK2MAPK14

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
WO-2017066672-A1 SENSOR DYES FOR REAL-TIME SENSING OF METAL IONS IN AQUEOUS ENVIRONMENTS UWM RESEARCH FOUNDATION, INC. (US) 2017-04-20 WO disclosed