SCHEMBL7942928

SCHEMBL7942928

O=S(=O)(O)c1cccc(I)c1I

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.44
MYC P01106 1/20 0.37
CDK2 P24941 2/20 0.36
FABP4 P15090 1/20 0.36
CCNA2 P20248 1/20 0.36
MAPK14 Q16539 1/20 0.36
TSHR P16473 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NR4A1 P22736 1/20 0.35
AURKA O14965 1/20 0.34
AURKB Q96GD4 1/20 0.34
CYP1A2 P05177 3/20 0.34
SNCA P37840 2/20 0.33
CHAT P28329 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL29566694 0.81 TSHR (0.44) TTRMYCCDK2FABP4CCNA2
SCHEMBL2567985 0.81 TSHR (0.44) TTRMYCCDK2FABP4CCNA2
SCHEMBL9262066 0.81 GAA (0.41) CDK2TSHRCYP1A2TDP1TP53
SCHEMBL27958860 0.80 AURKA (0.44) TTRMYCCDK2FABP4CCNA2
SCHEMBL6913540 0.79 MYC (0.42) TTRMYCCDK2FABP4CCNA2
SCHEMBL6915014 0.79 MYC (0.42) TTRMYCCDK2FABP4CCNA2
SCHEMBL6913794 0.79 MYC (0.42) TTRMYCCDK2FABP4CCNA2
SCHEMBL6916728 0.79 MYC (0.42) TTRMYCCDK2FABP4CCNA2
SCHEMBL6915139 0.79 MYC (0.42) TTRMYCCDK2FABP4CCNA2
SCHEMBL15525175 0.79 MYC (0.42) TTRMYCCDK2FABP4CCNA2

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
US-6225132-B1 DERIVATIZING AGENT COMPRISING A MULTIPHOTON-EMITTING RADIOISOTOPE AND A MOIETY THAT FORMS A NON-COVALENT CHEMICAL BOND WITH AN ANALYTE OF INTEREST, SUITABLE FOR DETECTION OF THE ANALYTE OF INTEREST BIOTRACES, INC. 2001-05-01 US disclosed
EP-0912899-A1 ENHANCED CHROMATOGRAPHY USING MULTIPHOTON DETECTION Biotraces, Inc. (US) 1999-05-06 EP disclosed
US-5854084-A Enhanced chromatography using multiphoton detection BIOTRACES, INC. (US) 1998-12-29 US disclosed
WO-1998002750-A1 ENHANCED CHROMATOGRAPHY USING MULTIPHOTON DETECTION BIOTRACES, INC. (US) 1998-01-22 WO disclosed