SCHEMBL9275183

SCHEMBL9275183

COc1cc(OC)c(NC(=O)N(Cc2ccccc2)C2CCC(c3ccccc3)CC2)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UBE2M P61081 13/20 0.49
DCUN1D1 Q96GG9 13/20 0.49
ROCK2 O75116 1/20 0.45
THRB P10828 1/20 0.44
LMNA P02545 2/20 0.43
USP2 O75604 3/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NPSR1 Q6W5P4 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
SCHEMBL9273627 0.89 THRB (0.54) UBE2MDCUN1D1THRBLMNAUSP2
SCHEMBL9273625 0.89 THRB (0.54) UBE2MDCUN1D1THRBLMNAUSP2
SCHEMBL9266858 0.83 ALDH1A1 (0.40) THRBLMNAUSP2ALDH1A1KDM4E
SCHEMBL9266860 0.83 ALDH1A1 (0.40) THRBLMNAUSP2ALDH1A1KDM4E
SCHEMBL9257513 0.82 THRB (0.50) UBE2MDCUN1D1ROCK2THRBLMNA
SCHEMBL9274697 0.82 UBE2M (0.50) UBE2MDCUN1D1THRBLMNAUSP2
SCHEMBL9274690 0.82 UBE2M (0.50) UBE2MDCUN1D1THRBLMNAUSP2
SCHEMBL9273323 0.81 DCUN1D1 (0.48) UBE2MDCUN1D1THRB
SCHEMBL9273319 0.81 DCUN1D1 (0.48) UBE2MDCUN1D1THRB
SCHEMBL9271572 0.80 DCUN1D1 (0.50) UBE2MDCUN1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5420164-A Enzyme inhibitors YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-05-30 US claimed
EP-0507291-A1 Cyclohexylurea compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-10-07 EP claimed
US-5420164-A Enzyme inhibitors YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-05-30 US disclosed
EP-0507291-A1 Cyclohexylurea compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-10-07 EP disclosed