SCHEMBL6430746

SCHEMBL6430746

O=S(=O)(NC(S)CO)c1ccc(F)c2nonc12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.41
KMT2A Q03164 3/20 0.37
POLB P06746 1/20 0.37
RORA P35398 1/20 0.35
RORC P51449 1/20 0.35
NR1H2 P55055 1/20 0.35
TP53 P04637 2/20 0.34
FEN1 P39748 5/20 0.33
ALDH1A1 P00352 6/20 0.33
GSTP1 P09211 1/20 0.32
MAPK1 P28482 1/20 0.32
IDO1 P14902 1/20 0.32
ALOX5AP P20292 3/20 0.31
MEN1 O00255 1/20 0.31
TSHR P16473 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
SCHEMBL22734625 0.75 KMT2A (0.38) CHRM1KMT2APOLBRORARORC
Trimethylammonium SCHEMBL22734573 0.74 KMT2A (0.37) CHRM1KMT2APOLBRORARORC
Hydrochloric Acid SCHEMBL22734577 0.74 KMT2A (0.37) CHRM1KMT2APOLBRORARORC
SCHEMBL4941108 0.72 CHRM1 (0.41) CHRM1KMT2APOLBRORARORC
SCHEMBL1271332 0.72 TET2 (0.46) CHRM1KMT2APOLBRORARORC
2-Mercaptoethanol SCHEMBL7908916 0.71 TET2 (0.39) CHRM1KMT2APOLBTP53ALDH1A1
Ammonia Solution, Strong SCHEMBL591415 0.70 TET2 (0.45) CHRM1KMT2APOLBRORARORC
SCHEMBL2530974 0.70 POLB (0.40) CHRM1KMT2APOLBRORARORC
SCHEMBL4942470 0.69 RORA (0.40) CHRM1KMT2APOLBRORARORC
SCHEMBL571688 0.69 TET2 (0.46) CHRM1KMT2APOLBRORARORC

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-20050250170-A1 Determination of metal ions in solution by photoluminescence anisotropy THOMPSON, RICHARD B. 2005-11-10 US claimed