SCHEMBL8740694

SCHEMBL8740694

CCc1ccccc1OC(=S)c1c2ccccc2nc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TNKS2 Q9H2K2 1/20 0.40
KDM4E B2RXH2 5/20 0.40
POLB P06746 4/20 0.40
GLA P06280 2/20 0.40
NPC1 O15118 1/20 0.39
ALOX15 P16050 2/20 0.38
GAA P10253 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
PDE10A Q9Y233 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
RAB9A P51151 2/20 0.37
MAPK1 P28482 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TOP2A P11388 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL8333201 0.81 POLB (0.52) MAPTKDM4EPOLBNPC1ALOX15
SCHEMBL6930359 0.78 MAOA (0.43) MAPTKDM4EPOLBGLANPC1
SCHEMBL8581655 0.77 PDE10A (0.41) MAPTNPSR1POLBNPC1ALDH1A1
SCHEMBL7756511 0.75 KDM4E (0.48) MAPTNPSR1KDM4EPOLBGLA
SCHEMBL8049966 0.74 MAPT (0.46) MAPTNPSR1KDM4EPOLBGLA
SCHEMBL7027183 0.72 POLB (0.51) MAPTNPSR1TNKS2KDM4EPOLB
SCHEMBL7024083 0.72 POLB (0.43) MAPTNPSR1KDM4EPOLBGLA
SCHEMBL7030411 0.72 SCN9A (0.43) MAPTKDM4EGLAALDH1A1HPGD
SCHEMBL27810295 0.71 L3MBTL1 (0.47) MAPTNPSR1KDM4EGAAALDH1A1
SCHEMBL5553018 0.70 L3MBTL1 (0.43) MAPTNPSR1KDM4EGAAALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0755457-A4 NOVEL ARYL-N-ALKYLACRIDANTHIOCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 1997-07-16 EP disclosed
EP-0755457-A1 NOVEL ARYL-N-ALKYLACRIDANTHIOCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1997-01-29 EP disclosed
WO-1995028495-A1 NOVEL ARYL-N-ALKYLACRIDANTHIOCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1995-10-26 WO disclosed