SCHEMBL8418200

SCHEMBL8418200

NC(=O)C(=S=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.52
CYP2C19 P33261 2/20 0.52
TSHR P16473 2/20 0.52
CYP3A4 P08684 2/20 0.52
MAPT P10636 2/20 0.52
BLM P54132 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
POLB P06746 1/20 0.52
PARP1 P09874 1/20 0.52
RECQL P46063 1/20 0.52
PMP22 Q01453 1/20 0.52
HSD17B10 Q99714 1/20 0.52
GAA P10253 1/20 0.47
CES1 P23141 5/20 0.44
CES2 O00748 4/20 0.44
ALDH1A1 P00352 3/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
F2 P00734 2/20 0.41
CA2 P00918 2/20 0.41

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
SCHEMBL9417408 0.81 CES1 (0.48) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL28129843 0.79 CES2 (0.59) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL5947952 0.72 TSHR (0.52) TDP1TSHRCYP3A4MAPTHSD17B10
SCHEMBL958533 0.70 TDP1 (0.62) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL7567511 0.70 TDP1 (0.62) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL147282 0.70 CES2 (0.68) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL1415252 0.70 TDP1 (0.62) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL2905276 0.70 TDP1 (0.62) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL10497226 0.70 TDP1 (0.62) TDP1CYP2C19TSHRCYP3A4MAPT
SCHEMBL27325956 0.70 TDP1 (0.62) TDP1CYP2C19TSHRCYP3A4MAPT

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-5939431-A Naphthyridines which affect IL-4 and G-CSF SCHERING CORPORATION (US) 1999-08-17 US disclosed