SCHEMBL8310604

SCHEMBL8310604

CCOc1cc(C=C2SC(=S)N(C)C2=O)cc(-c2ccccc2SC)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
NAT1 P18440 1/20 0.48
MEN1 O00255 8/20 0.48
KMT2A Q03164 8/20 0.48
POLB P06746 4/20 0.48
GAA P10253 3/20 0.48
FABP4 P15090 1/20 0.48
ALDH1A1 P00352 4/20 0.47
RECQL P46063 2/20 0.47
NPC1 O15118 1/20 0.47
THRB P10828 1/20 0.47
ALOX12 P18054 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CISD1 Q9NZ45 2/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
PTP4A3 O75365 1/20 0.46
MAPK1 P28482 1/20 0.45

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
SCHEMBL8310599 1.00 MAPT (0.56) MAPTNAT1MEN1KMT2APOLB
SCHEMBL8986231 0.89 KMT2A (0.46) MAPTMEN1KMT2APOLBGAA
SCHEMBL8933459 0.89 KMT2A (0.46) MAPTMEN1KMT2APOLBGAA
SCHEMBL8991958 0.89 KMT2A (0.46) MAPTMEN1KMT2APOLBGAA
SCHEMBL8309496 0.87 FABP4 (0.55) MAPTMEN1KMT2APOLBGAA
SCHEMBL8307815 0.83 DYRK1A (0.61) MAPTNAT1MEN1KMT2APOLB
SCHEMBL8307819 0.83 DYRK1A (0.61) MAPTNAT1MEN1KMT2APOLB
SCHEMBL8991940 0.83 GAA (0.40) MAPTMEN1KMT2APOLBGAA
SCHEMBL8933490 0.83 GAA (0.40) MAPTMEN1KMT2APOLBGAA
SCHEMBL8310606 0.79 MAPT (0.56) MAPTNAT1MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523314-A RHODANINE DERIVATIVES ELI LILLY AND COMPANY (US) 1996-06-04 US claimed
EP-0915090-A1 Compounds useful as hypoglycemic agents and for treating Alzheimer's disease ELI LILLY AND COMPANY (US) 1999-05-12 EP disclosed
US-5661168-A ADMINISTERING RHODANINE DERIVATIVES TO CONTROL DIABETES ELI LILLY AND COMPANY (US) 1997-08-26 US disclosed
US-5523314-A RHODANINE DERIVATIVES ELI LILLY AND COMPANY (US) 1996-06-04 US disclosed
EP-0587377-A2 Thiazolidinone derivatives as hypoglycemic agents and for treating Alzheimer's disease ELI LILLY AND COMPANY (US) 1994-03-16 EP disclosed