SCHEMBL8661973

SCHEMBL8661973

CCOC(=O)CN(C(=S)Nc1cc(Cl)ccc1C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
DUSP3 P51452 1/20 0.48
PTPN5 P54829 1/20 0.48
PTPN11 Q06124 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAPK1 P28482 1/20 0.46
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
LMNA P02545 4/20 0.45
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 3/20 0.44
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL7835655 0.73 CA12 (0.53) KDM4ESMN1; SMN2GAALMNAMEN1
SCHEMBL656591 0.72 CNR2 (0.52) KDM4ESMN1; SMN2GAATSHR
SCHEMBL20169531 0.71 SMN1; SMN2 (0.59) KDM4ESMN1; SMN2POLBGAALMNA
SCHEMBL27861387 0.71 GAA (0.63) SMN1; SMN2POLBGAALMNAMEN1
SCHEMBL6382412 0.71 SMN1; SMN2 (0.59) KDM4ESMN1; SMN2POLBGAALMNA
SCHEMBL6096096 0.71 GAA (0.56) KDM4EPOLBGAALMNAMEN1
SCHEMBL8687124 0.71 KDM4E (0.53) KDM4EDUSP3PTPN5PTPN11SMN1; SMN2
SCHEMBL8915368 0.71 CA2 (0.48) KDM4ESMN1; SMN2POLBGAAKMT2A
SCHEMBL2635519 0.70 SMN1; SMN2 (0.57) KDM4ESMN1; SMN2POLBGAALMNA
SCHEMBL8661971 0.70 MAPT (0.37) KDM4ESMN1; SMN2MAPK1GAAMEN1

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-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 disclosed
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 disclosed
US-5554607-A INCREASING HDL CHOLESTEROL AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-10 US disclosed