SCHEMBL7439749

SCHEMBL7439749

CCOC(=O)CNC1c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
CYP1A2 P05177 2/20 0.49
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
PPID Q08752 1/20 0.46
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
IDO1 P14902 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43
LTA4H P09960 1/20 0.42
MAPT P10636 1/20 0.42
GAA P10253 1/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL612420 0.87 BCHE (0.50) POLBCYP1A2BCHEACHEPPID
SCHEMBL7435438 0.85 BCHE (0.49) POLBBCHEACHEKMT2AMEN1
SCHEMBL9396517 0.85 BCHE (0.54) POLBCYP1A2BCHEACHEKMT2A
Hydrochloric Acid SCHEMBL9651566 0.84 BCHE (0.47) POLBBCHEACHEKMT2AMEN1
SCHEMBL9788719 0.82 ALDH1A1 (0.50) BCHEACHEKMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL9654007 0.81 MAPT (0.49) CYP1A2BCHEACHEKMT2AMEN1
SCHEMBL28621243 0.78 BCHE (0.51) POLBCYP1A2BCHEACHEKMT2A
SCHEMBL7840846 0.78 KMT2A (0.54) CYP1A2KMT2AMEN1LMNATSHR
SCHEMBL2254514 0.76 MAPT (0.53) POLBCYP1A2BCHEACHEKMT2A
SCHEMBL14490950 0.76 KMT2A (0.55) POLBCYP1A2PPIDKMT2A

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