SCHEMBL8891815

SCHEMBL8891815

CNC(=S)NS(=O)(=O)c1cc(CC(=O)NC(C)c2ccco2)ccc1OC

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 1/20 0.48
ABCC8 Q09428 1/20 0.48
KCNJ11 Q14654 1/20 0.48
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 1/20 0.40
POLB P06746 2/20 0.39
RAB9A P51151 1/20 0.39
P2RX7 Q99572 1/20 0.39
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL8891687 0.91 LMNA (0.43) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8898777 0.91 ALDH1A1 (0.41) ABCC9ABCC8KCNJ11ALDH1A1POLB
SCHEMBL8894254 0.90 NPSR1 (0.44) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8891401 0.89 ABCC9 (0.47) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8891448 0.88 KDM4E (0.42) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8894141 0.86 KMT2A (0.51) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8891360 0.86 ABCC9 (0.50) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8891256 0.85 KDM4E (0.34) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8890978 0.85 ABCC9 (0.47) ABCC9ABCC8KCNJ11KMT2AGAA
SCHEMBL8893327 0.83 ABCC9 (0.47) ABCC9ABCC8KCNJ11KMT2AGAA

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-5607976-A ANNTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed