SCHEMBL7546248

SCHEMBL7546248

Cc1cn(Cc2ccccc2)c(=O)[nH]c1=S

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.72
MAPK1 P28482 1/20 0.53
TK1 P04183 3/20 0.47

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
SCHEMBL3996660 0.84 HPGD (1.00) HPGDMAPK1TK1
SCHEMBL11723021 0.76 SMN1; SMN2 (0.44) HPGDMAPK1TK1
SCHEMBL7546901 0.73 TK1 (0.42) HPGDMAPK1TK1
SCHEMBL27734975 0.73 HPGD (0.61) HPGDMAPK1
SCHEMBL7821405 0.73 HPGD (0.69) HPGDMAPK1TK1
SCHEMBL7834073 0.73 HPGD (0.76) HPGDMAPK1TK1
SCHEMBL7549198 0.72 TYMP (0.43) HPGDMAPK1TK1
SCHEMBL24495513 0.71 DAO (0.72) HPGDMAPK1
SCHEMBL4172709 0.71 HPGD (0.67) HPGDMAPK1TK1
SCHEMBL7554990 0.71 TK1 (0.47) HPGDMAPK1TK1

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-1165554-A1 NEW ENDOTHELIN CONVERTING ENZYME INHIBITORS, THEIR PRODUCTION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2002-01-02 EP disclosed
WO-2000061579-A1 NEW ENDOTHELIN CONVERTING ENZYME INHIBITORS, THEIR PRODUCTION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2000-10-19 WO disclosed