SCHEMBL8894341

SCHEMBL8894341

CNC(=S)NS(=O)(=O)c1cc(CC(=O)NC(C)c2cccs2)ccc1SC

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
TSHR P16473 1/20 0.37
POLB P06746 5/20 0.35
HPGD P15428 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.34
LMNA P02545 3/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
ABCC9 O60706 1/20 0.33
ABCC8 Q09428 1/20 0.33
KCNJ11 Q14654 1/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
CA2 P00918 1/20 0.32

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
SCHEMBL8890064 0.91 L3MBTL1 (0.43) L3MBTL1TSHRPOLBHPGDALDH1A1
SCHEMBL8892035 0.90 LMNA (0.33) L3MBTL1TSHRPOLBALDH1A1LMNA
SCHEMBL8890328 0.88 L3MBTL1 (0.43) L3MBTL1TSHRPOLBHPGDALDH1A1
SCHEMBL8891470 0.86 ABCC9 (0.47) L3MBTL1TSHRPOLBPKMLMNA
SCHEMBL8891787 0.85 HTT (0.35) HPGDALDH1A1MAPTPKMLMNA
SCHEMBL8892423 0.84 NPC1 (0.35) POLBALDH1A1PKMLMNAKMT2A
SCHEMBL8890853 0.84 L3MBTL1 (0.41) L3MBTL1TSHRPOLBHPGDALDH1A1
SCHEMBL8892350 0.84 ABCC9 (0.33) HPGDALDH1A1MAPTLMNAKMT2A
SCHEMBL8891256 0.83 KDM4E (0.34) HPGDALDH1A1MAPTLMNAKMT2A
SCHEMBL8893925 0.83 L3MBTL1 (0.40) L3MBTL1TSHRPOLBHPGDALDH1A1

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