SCHEMBL8663389

SCHEMBL8663389

CCC1NC(=S)N(CCc2ccccc2)C1=O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.56
POLB P06746 3/20 0.56
HTT P42858 1/20 0.54
PAX8 Q06710 1/20 0.54
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 5/20 0.47
CYP1A2 P05177 3/20 0.47
CYP3A4 P08684 3/20 0.47
CYP2C19 P33261 3/20 0.47
CYP2C9 P11712 2/20 0.47
MAPT P10636 1/20 0.47
GSK3A P49840 2/20 0.45
GSK3B P49841 2/20 0.45
MGLL Q99685 1/20 0.45
MEN1 O00255 2/20 0.44
LMNA P02545 1/20 0.44
CNR1 P21554 1/20 0.42

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
SCHEMBL12877356 0.73 GAA (0.70) GAAPOLBHTTPAX8KMT2A
SCHEMBL28049452 0.72 GAA (1.00) GAAPOLBHTTPAX8KMT2A
SCHEMBL8663762 0.71 GAA (0.56) GAAPOLBHTTPAX8KMT2A
SCHEMBL9637298 0.71 GAA (0.67) GAAPOLBHTTPAX8KMT2A
SCHEMBL3628602 0.71 NPSR1 (0.46) GAAPOLBHTTPAX8KMT2A
SCHEMBL12205992 0.70 ALDH1A1 (0.58) GAAHTTKMT2AKDM4EALDH1A1
SCHEMBL19419936 0.69 GAA (0.68) GAAPOLBHTTPAX8KMT2A
SCHEMBL8671548 0.69 KMT2A (0.51) GAAPOLBHTTPAX8KMT2A
SCHEMBL8385141 0.69 NPSR1 (0.59) GAAPOLBHTTPAX8KMT2A
SCHEMBL14680244 0.69 GAA (0.72) GAAPOLBHTTPAX8KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876355-A1 2-THIOXO-IMIDAZOLIDIN-4-ONE DERIVATIVES AND THEIR USE FOR INCREASING HDL CHOLESTEROL CONCENTRATION AMERICAN HOME PRODUCTS CORPORATION (US) 1998-11-11 EP claimed
WO-1997019932-A1 2-THIOXO-IMIDAZOLIDIN-4-ONE DERIVATIVES AND THEIR USE FOR INCREASING HDL CHOLESTEROL CONCENTRATION AMERICAN HOME PRODUCTS CORPORATION (US) 1997-06-05 WO claimed