SCHEMBL7428792

SCHEMBL7428792

O=C(O)CN1CC(=O)N(C(S)CCc2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.45
CYP2C19 P33261 2/20 0.45
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.45
KMT2A Q03164 1/20 0.45
ACE P12821 10/20 0.44
ENPP2 Q13822 1/20 0.42
NPSR1 Q6W5P4 1/20 0.40
MME P08473 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL7426522 0.88 MAPT (0.43) POLBKMT2AENPP2NPSR1
SCHEMBL7436003 0.85 HDAC6 (0.42) POLBKMT2AACEENPP2
SCHEMBL7432645 0.85 ENPP2 (0.47) CYP2D6CYP2C19POLBCYP2C9KMT2A
SCHEMBL7428456 0.84 PLA2G10 (0.45) POLBACEENPP2NPSR1
SCHEMBL7445702 0.81 ACHE (0.40) POLBKMT2AENPP2NPSR1
SCHEMBL7435811 0.79 ACHE (0.41) CYP2D6CYP2C19POLBCYP2C9KMT2A
SCHEMBL7438165 0.79 ENPP2 (0.40) CYP2D6CYP2C19POLBCYP2C9KMT2A
SCHEMBL7446529 0.78 ACE (0.41) POLBKMT2AACENPSR1
SCHEMBL7440468 0.78 POLB (0.37) POLBKMT2ANPSR1
SCHEMBL7440735 0.77 L3MBTL1 (0.42) KMT2AENPP2

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