SCHEMBL7429554

SCHEMBL7429554

CCOC(=O)CNc1ccccc1CC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 1/20 0.44
THRB P10828 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PPID Q08752 1/20 0.43
HTT P42858 2/20 0.41
MAPT P10636 1/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 2/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
ELANE P08246 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
PKM P14618 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
SCHEMBL1732516 0.85 ALDH1A1 (0.42) L3MBTL1ALDH1A1KDM4ETHRBTDP1
SCHEMBL948953 0.83 ALDH1A1 (0.51) ALDH1A1THRBTDP1HTTMAPT
SCHEMBL7415643 0.83 ALDH1A1 (0.54) ALDH1A1KDM4ETHRBTDP1PPID
SCHEMBL23656551 0.80 CYP4F2 (0.49) L3MBTL1ALDH1A1KDM4EPPIDHTT
SCHEMBL31518562 0.80 KDM4E (0.57) ALDH1A1KDM4ETDP1PPIDHTT
SCHEMBL28752859 0.80 THRB (0.47) L3MBTL1ALDH1A1KDM4ETHRBTDP1
SCHEMBL28250551 0.79 ALDH1A1 (0.46) ALDH1A1KDM4ETHRBTDP1PPID
SCHEMBL25900213 0.79 PKM (0.49) L3MBTL1ALDH1A1KDM4ELMNACYP4F2
SCHEMBL10908456 0.78 CYP1A2 (0.48) ALDH1A1KDM4EHTTMAPTPKM
SCHEMBL27861807 0.77 ALDH1A1 (0.47) ALDH1A1KDM4ETHRBTDP1PPID

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