SCHEMBL7439151

SCHEMBL7439151

CC(C)C[C@@H](C(=O)O)N1CC(=O)N(C(CS)Cc2ccccc2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.46
ALDH1A1 P00352 2/20 0.45
PKM P14618 1/20 0.45
ACE P12821 4/20 0.43
CPA3 P15088 1/20 0.41
FOLH1 Q04609 1/20 0.41
ALOX15 P16050 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL7442303 0.90 ALDH1A1 (0.53) ALDH1A1PKMCPA3FOLH1ALOX15
SCHEMBL7446522 0.86 CPA3 (0.44) MMEALDH1A1PKMCPA3FOLH1
SCHEMBL7437103 0.84 MME (0.43) MMEALDH1A1PKMCPA3FOLH1
SCHEMBL7435392 0.84 MME (0.43) MMEALDH1A1PKMCPA3FOLH1
SCHEMBL7432083 0.81 ACE (0.44) MMEALDH1A1PKMACECPA3
SCHEMBL7439156 0.80 MME (0.44) MMEALDH1A1PKMACE
SCHEMBL7435805 0.80 CPA3 (0.38) MMEALDH1A1PKMACECPA3
SCHEMBL7431966 0.78 MEN1 (0.41) MMEALDH1A1PKMCPA3FOLH1
SCHEMBL7433437 0.78 DNMT1 (0.57) PKMMAPTSMN1; SMN2GAA
SCHEMBL7426791 0.77 CPA3 (0.38) MMEALDH1A1PKMCPA3FOLH1

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