SCHEMBL8310456

SCHEMBL8310456

O=C1NC(=S)SC1=CCc1ccc2ccccc2c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 4/20 0.61
RAB9A P51151 2/20 0.61
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
PTP4A3 O75365 3/20 0.50
NAT1 P18440 2/20 0.48
CA2 P00918 1/20 0.48
EPHX1 P07099 1/20 0.48
ADAMTS5 Q9UNA0 2/20 0.47
NPC1 O15118 1/20 0.46
MYC P01106 1/20 0.46
MAX P61244 1/20 0.46
MMP13 P45452 4/20 0.46
MMP3 P08254 3/20 0.45
GSK3B P49841 1/20 0.44

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
SCHEMBL8708384 1.00 PIM1 (0.61) PIM1RAB9AMEN1KMT2APTP4A3
SCHEMBL8171894 0.83 NAT1 (0.59) PIM1MEN1KMT2APTP4A3NAT1
SCHEMBL18102998 0.83 NAT1 (0.59) PIM1MEN1KMT2APTP4A3NAT1
SCHEMBL8311453 0.80 MMP13 (0.65) PTP4A3NAT1CA2EPHX1ADAMTS5
SCHEMBL8714982 0.80 MMP13 (0.65) PTP4A3NAT1CA2EPHX1ADAMTS5
SCHEMBL8713697 0.78 NAT1 (0.61) PIM1RAB9AMEN1KMT2APTP4A3
SCHEMBL8307763 0.78 NAT1 (0.61) PIM1RAB9AMEN1KMT2APTP4A3
SCHEMBL8172015 0.77 MYC (0.61) PIM1RAB9APTP4A3NAT1CA2
SCHEMBL8166533 0.77 NPC1 (0.54) PIM1RAB9AMEN1KMT2ANAT1
SCHEMBL8173323 0.77 CSNK2A2 (0.64) PIM1RAB9AMEN1KMT2ANAT1

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
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-5716975-A NONTOXIC RHODANINE DERIVATIVES; ANTIDIABETIC AGENTS, CATHEPSIN D INHIBITORS, B-AMYLOID PROTEIN REDUCTION ELI LILLY AND COMPANY (US) 1998-02-10 US disclosed
US-5523314-A RHODANINE DERIVATIVES ELI LILLY AND COMPANY (US) 1996-06-04 US disclosed
CN-1091006-A Chemical compound as blood sugar lowering and treatment degenerative brain disorder LILLY CO ELI (US) 1994-08-24 CN 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