SCHEMBL5013394

SCHEMBL5013394

[O]c1ccc2scnc2c1N1CCN(Cc2cc(Cl)c(Cl)c(Cl)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.36
DRD4 P21917 2/20 0.35
DRD3 P35462 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL5013397 0.87 DRD2 (0.36) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL2092799 0.83 MALT1 (0.34) DRD2MEN1KMT2ALMNA
SCHEMBL27645184 0.80 DRD2 (0.48) DRD2DRD4DRD3
SCHEMBL5013426 0.77 RBP4 (0.40) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL2092243 0.76 MALT1 (0.35) DRD2
SCHEMBL5013395 0.71 MEN1 (0.47) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL5016097 0.71 KDM4E (0.44) DRD2DRD4DRD3
SCHEMBL2092802 0.70 MALT1 (0.34) DRD2MEN1KMT2A
SCHEMBL5011858 0.69 DRD4 (0.44) DRD2DRD4DRD3LMNA
SCHEMBL5016095 0.68 ALDH1A1 (0.43) DRD2DRD4DRD3MEN1KMT2A

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-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed