SCHEMBL6911279

SCHEMBL6911279

O=S(=O)(O)c1cccc2cccc(NI)c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.64
FABP4 P15090 1/20 0.64
CCNA2 P20248 1/20 0.64
CDK2 P24941 1/20 0.64
MAPK14 Q16539 1/20 0.64
NR4A1 P22736 1/20 0.62
CD40 P25942 3/20 0.45
CD40LG P29965 3/20 0.45
SNCA P37840 2/20 0.41
CHAT P28329 1/20 0.41
FABP1 P07148 1/20 0.38
CASP6 P55212 1/20 0.38
MPL P40238 2/20 0.36
TSHR P16473 1/20 0.36
ATIC P31939 1/20 0.35
F2 P00734 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
CTRC Q99895 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
SCHEMBL23178061 0.82 TTR (0.64) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL1742117 0.80 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL18769044 0.79 TTR (0.60) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL21725437 0.79 TTR (0.60) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL14511497 0.79 TTR (0.46) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL43158 0.78 FABP4 (1.00) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL27459951 0.78 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL11759224 0.78 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL29381891 0.78 FABP4 (1.00) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL1786500 0.77 FABP4 (0.97) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040038254-A1 Compositions and methods for detecting nucleic acid methylation THIEN, DOUGLAS Y. 2004-02-26 US disclosed
EP-0063852-A2 Energy absorbing particle quenching in light emitting competitive protein binding assays SYVA COMPANY (US) 1982-11-03 EP disclosed