SCHEMBL10914765

SCHEMBL10914765

Cc1ccc(S(=O)(=O)N[C@H](C(=O)O)[C@@H](C)N[C@H](Cc2c[nH]cn2)C(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 9/20 0.48
▸ MMP9 P14780 8/20 0.48
▸ MMP3 P08254 6/20 0.48
▸ MMP13 P45452 6/20 0.48
▸ MMP1 P03956 4/20 0.48
▸ MMP7 P09237 4/20 0.48
▸ SLC1A3 P43003 1/20 0.46
▸ SLC1A2 P43004 1/20 0.46
▸ SLC1A1 P43005 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.44
▸ ADAMTS4 O75173 5/20 0.41
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38

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
SCHEMBL10612379 0.92 MMP9 (0.46) MMP2MMP9MMP3MMP13MMP1
SCHEMBL10614339 0.91 MMP13 (0.43) MMP2MMP9MMP3MMP13MMP1
SCHEMBL9221798 0.87 TDP1 (0.57) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6514467 0.87 TDP1 (0.57) MMP2MMP9MMP3MMP13MMP1
SCHEMBL5173100 0.87 TDP1 (0.57) MMP2MMP9MMP3MMP13MMP1
SCHEMBL10611069 0.82 TDP1 (0.49) MMP2MMP9MMP3MMP13MMP1
Imidazole SCHEMBL28169637 0.80 TDP1 (0.49) MMP2MMP9MMP3MMP13SLC1A3
Imidazole SCHEMBL7269081 0.80 TDP1 (0.49) MMP2MMP9MMP3MMP13SLC1A3
SCHEMBL10614350 0.80 MMP9 (0.50) MMP2MMP9MMP3MMP13MMP1
SCHEMBL10586916 0.79 TDP1 (0.44) MMP2MMP9MMP3MMP13MMP1

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-0193904-A2 Amino acid derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-09-10 — — EP disclosed
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