SCHEMBL7835655

SCHEMBL7835655

CCOC(=O)CN(C(=S)NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
SMN1; SMN2 Q16637 7/20 0.49
HTT P42858 3/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
ALOX12 P18054 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 6/20 0.46
GAA P10253 3/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
MEN1 O00255 2/20 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
SCHEMBL6607753 0.79 SMN1; SMN2 (0.57) SMN1; SMN2HTTALDH1A1GAAKDM4E
SCHEMBL20169531 0.78 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1ALDH1A1GAALMNA
SCHEMBL8915368 0.78 CA2 (0.48) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL5807041 0.76 SMN1; SMN2 (0.60) SMN1; SMN2L3MBTL1NPSR1ALDH1A1GAA
SCHEMBL6901552 0.76 SMN1; SMN2 (0.60) SMN1; SMN2NPSR1ALDH1A1GAALMNA
SCHEMBL7443478 0.76 ALDH1A1 (0.47) SMN1; SMN2HTTL3MBTL1ALOX12NPSR1
SCHEMBL7174025 0.75 SMN1; SMN2 (0.56) SMN1; SMN2NPSR1ALDH1A1GAALMNA
SCHEMBL6382412 0.75 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1ALDH1A1GAALMNA
SCHEMBL11437661 0.75 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1ALDH1A1GAALMNA
SCHEMBL15400292 0.74 MAPT (0.58) SMN1; SMN2CYP1A2CYP2C9CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721944-B1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LTD (JP) 2001-01-17 EP disclosed