SCHEMBL7440724

SCHEMBL7440724

O=C1CN(Cc2cccc3ccccc23)C(=O)N1C(CS)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.43
ENPP2 Q13822 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
HDAC1 Q13547 1/20 0.36
CMA1 P23946 1/20 0.36
CLPP Q16740 5/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
DAO P14920 1/20 0.34

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
SCHEMBL7432640 0.84 ENPP2 (0.47) ENPP2L3MBTL1CMA1MEN1KMT2A
SCHEMBL7440735 0.81 L3MBTL1 (0.42) ENPP2L3MBTL1HDAC1CMA1CLPP
SCHEMBL7428787 0.76 KMT2A (0.45) ENPP2MEN1KMT2AALDH1A1
SCHEMBL7445692 0.75 ENPP2 (0.36) ENPP2MEN1KMT2AALDH1A1
SCHEMBL7426519 0.74 MME (0.42) ENPP2L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL7435994 0.73 MME (0.41) ENPP2HDAC1MEN1KMT2AALDH1A1
SCHEMBL7435805 0.72 CPA3 (0.38) MEN1KMT2AALDH1A1
SCHEMBL7426791 0.70 CPA3 (0.38) L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL7428452 0.70 PLA2G10 (0.45) HRH4ENPP2ALDH1A1
SCHEMBL7425886 0.69 HSD11B1 (0.44) CMA1MEN1KMT2AALDH1A1GAA

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-0640594-A1 Hydantoin derivative as metalloprotease inhibitor FUJIREBIO INC. (JP) 1995-03-01 EP disclosed