SCHEMBL6170816

SCHEMBL6170816

CC1(c2ccc(Oc3ccccc3)cc2)NC(=S)N(CCCN2CCOCC2)C1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 1/20 0.47
HTT P42858 1/20 0.46
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.43
HRH3 Q9Y5N1 2/20 0.41
SLC6A4 P31645 1/20 0.41
CSF1R P07333 1/20 0.41
FAAH O00519 1/20 0.40
HRH1 P35367 1/20 0.40
CNR1 P21554 1/20 0.39
HPGD P15428 1/20 0.39
TACR2 P21452 2/20 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
SCHEMBL6168721 0.77 CNR1 (0.54) MEN1TSHRKMT2AALDH1A1GAA
SCHEMBL6169138 0.75 CNR1 (0.49) MEN1TSHRKMT2AHTTALDH1A1
SCHEMBL6169070 0.71 FAAH (0.50) TSHRALDH1A1GAAFAAHCNR1
SCHEMBL5954860 0.71 CSF1R (0.43) KMT2AHTTALDH1A1HRH3CSF1R
SCHEMBL6167711 0.70 CNR1 (0.50) TSHRHTTALDH1A1GAACNR1
SCHEMBL6624966 0.70 MAPT (0.47) MEN1TSHRKMT2AHTTALDH1A1
SCHEMBL11720675 0.69 HRH1 (0.77) HRH3HRH1CNR1
SCHEMBL7567492 0.67 HRH1 (0.61) ALDH1A1HRH3HRH1CNR1
SCHEMBL6625012 0.67 CNR1 (0.46) MEN1TSHRKMT2AHTTALDH1A1
SCHEMBL6168870 0.67 GAA (0.46) MEN1KMT2AALDH1A1GAACNR1

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