SCHEMBL6170632

SCHEMBL6170632

CC1(c2ccc(Oc3ccccc3)cc2)NC(=S)N(c2ccc3c(c2)OCO3)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CRHBP P24387 3/20 0.42
CRHR2 Q13324 3/20 0.42
CMA1 P23946 1/20 0.41
DYRK1A Q13627 1/20 0.41
DYRK2 Q92630 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRL1 P41146 1/20 0.41
SCN9A Q15858 2/20 0.40
MMP13 P45452 1/20 0.40
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39

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
SCHEMBL6167711 0.83 CNR1 (0.50) ALDH1A1HTTDYRK1BMMP13GAA
SCHEMBL6624503 0.82 MAPT (0.54) ALDH1A1CRHBPCRHR2CMA1DYRK1A
SCHEMBL6168870 0.81 GAA (0.46) ALDH1A1MAPTMMP13GAASMN1; SMN2
SCHEMBL6169738 0.80 CNR1 (0.43) ALDH1A1HTTMMP13GAA
SCHEMBL6168455 0.79 PGR (0.41) ALDH1A1HTTCRHBPCRHR2OPRM1
SCHEMBL6168079 0.77 LMNA (0.47) ALDH1A1MAPTMMP13SMN1; SMN2
SCHEMBL6168712 0.76 CNR1 (0.46) ALDH1A1DYRK1BMAPTMMP13GAA
SCHEMBL6167462 0.75 CNR1 (0.41) ALDH1A1HTTMMP13GAASMN1; SMN2
SCHEMBL5955277 0.72 ALDH1A1 (0.53) ALDH1A1HTTNPSR1CMA1MAPT
SCHEMBL6170930 0.71 HSD11B1 (0.44) ALDH1A1HTTNPSR1MAPTPOLB

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-1546111-A2 2-THIOHYDANTOINE DERIVATIVE COMPOUNDS AND USE THEREOF FOR THE TREATMENT OF DIABETES LABORATOIRES FOURNIER S.A. (FR) 2005-06-29 EP disclosed
WO-2004031160-A2 2-THIOHYDANTOINE DERIVATIVE COMPOUNDS AND USE THEREOF FOR THE TREATMENT OF DIABETES LABORATOIRES FOURNIER S.A. (FR) 2004-04-15 WO disclosed