SCHEMBL6624582

SCHEMBL6624582

CC1(c2ccc(N3CCSCC3)cc2)NC(=S)N(c2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.45
HTR1A P08908 2/20 0.41
DRD2 P14416 2/20 0.41
HTR7 P34969 2/20 0.41
ALDH1A1 P00352 4/20 0.37
MAPT P10636 2/20 0.37
GRK5 P34947 1/20 0.36
TYRO3 Q06418 1/20 0.36
DYRK1B Q9Y463 1/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
CHRM3 P20309 1/20 0.34

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
SCHEMBL6625012 0.87 CNR1 (0.46) CNR1HTR1ADRD2HTR7ALDH1A1
SCHEMBL6625246 0.83 HTT (0.49) CNR1ALDH1A1MAPTHTTMEN1
SCHEMBL7481341 0.82 CNR1 (0.55) CNR1ALDH1A1MAPTGRK5TYRO3
SCHEMBL6627885 0.80 POLB (0.47) CNR1HTR1ADRD2HTR7ALDH1A1
SCHEMBL6625273 0.80 POLB (0.47) CNR1HTR1ADRD2HTR7ALDH1A1
SCHEMBL6628115 0.77 CNR1 (0.49) CNR1HTR1ADRD2HTR7ALDH1A1
SCHEMBL6624722 0.77 HTR1A (0.47) HTR1ADRD2HTR7ALDH1A1MAPT
SCHEMBL6623977 0.77 MGAT2 (0.40) CNR1HTR1ADRD2HTR7ALDH1A1
SCHEMBL6624454 0.77 HTT (0.42) HTR1ADRD2HTR7ALDH1A1MAPT
SCHEMBL6167711 0.77 CNR1 (0.50) CNR1ALDH1A1GRK5TYRO3DYRK1B

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-1373219-A1 THIOHYDANTOINS AND USE THEREOF FOR TREATING DIABETES LABORATOIRES FOURNIER S.A. (FR) 2004-01-02 EP disclosed
WO-2002081453-A1 THIOHYDANTOINS AND USE THEREOF FOR TREATING DIABETES LABORATOIRES FOURNIER SA (FR) 2002-10-17 WO disclosed