SCHEMBL7434337

SCHEMBL7434337

C[C@@H](C(=O)O)N1C(=O)N(C(CS)Cc2ccccc2)C(=O)C12CCCCC2

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.38
CPA3 P15088 1/20 0.37
FOLH1 Q04609 1/20 0.37
ALDH1A1 P00352 2/20 0.36
PKM P14618 1/20 0.36
GAA P10253 1/20 0.36
MME P08473 1/20 0.36
SLC1A2 P43004 1/20 0.36
TRPA1 O75762 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL7432557 0.80 ACE (0.40) CPA3FOLH1ALDH1A1PKMGAA
SCHEMBL7435582 0.78 ACE (0.40) CPA3FOLH1ALDH1A1PKMGAA
SCHEMBL7437844 0.76 HSD11B1 (0.38) ALDH1A1GAA
SCHEMBL7446522 0.74 CPA3 (0.44) CPA3FOLH1ALDH1A1PKMMME
SCHEMBL7432501 0.70 CPA3 (0.41) MMP1CPA3FOLH1ALDH1A1PKM
SCHEMBL7437087 0.70 ACE (0.37) CPA3FOLH1ALDH1A1PKMGAA
SCHEMBL7440989 0.69 ACE (0.40) CPA3FOLH1ALDH1A1GAAMME
SCHEMBL7431854 0.69 CPA3 (0.42) MMP1CPA3FOLH1ALDH1A1PKM
SCHEMBL7441046 0.68 CPA3 (0.38) CPA3FOLH1ALDH1A1GAAMME
SCHEMBL7426767 0.68 ACE (0.37) CPA3FOLH1ALDH1A1GAAMME

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