SCHEMBL16038164

SCHEMBL16038164

CCN(N[SH](=O)=O)S(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
PSIP1 O75475 1/20 0.42
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
APOBEC3G Q9HC16 1/20 0.41
CNR2 P34972 2/20 0.41
ESR1 P03372 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NR1I2 O75469 1/20 0.40
CCR5 P51681 1/20 0.40
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CNR1 P21554 1/20 0.38

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
SCHEMBL28008307 0.73 KMT2A (0.43) TDP1LMNAESR1TSHRKMT2A
SCHEMBL2058156 0.71 LMNA (0.70) TDP1PSIP1LMNAHTTAPOBEC3G
SCHEMBL17749354 0.71 ALDH1A1 (0.49) TDP1KMT2AHSD17B10KDM4E
SCHEMBL5191089 0.70 CCR5 (0.59) TDP1PSIP1LMNAHTTAPOBEC3G
SCHEMBL28043934 0.69 APOBEC3G (0.54) TDP1PSIP1LMNAAPOBEC3GTSHR
SCHEMBL17333390 0.68 PSIP1 (0.56) TDP1PSIP1LMNAHTTAPOBEC3G
SCHEMBL17333538 0.68 TDP1 (0.52) TDP1PSIP1LMNAHTTAPOBEC3G
SCHEMBL13286823 0.68 LMNA (0.61) TDP1PSIP1LMNAHTTAPOBEC3G
SCHEMBL28659411 0.68 TDP1 (0.52) TDP1PSIP1LMNAHTTAPOBEC3G
SCHEMBL17333377 0.68 APOBEC3G (0.59) TDP1PSIP1LMNAHTTAPOBEC3G

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
US-20140273038-A1 BIOLUMINESCENT METAL ION ASSAY Thompson, Richard B. (US) 2014-09-18 US claimed