SCHEMBL9738061

SCHEMBL9738061

CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 5/20 0.60
▸ MMP2 P08253 3/20 0.57
▸ MMP9 P14780 3/20 0.57
▸ SIRT2 Q8IXJ6 2/20 0.54
▸ SIRT1 Q96EB6 2/20 0.54
▸ CPB1 P15086 1/20 0.53
▸ CPB2 Q96IY4 1/20 0.53
▸ MMP1 P03956 1/20 0.52
▸ MMP3 P08254 1/20 0.52
▸ MMP7 P09237 1/20 0.52
▸ MMP13 P45452 1/20 0.52
▸ TGM2 P21980 1/20 0.52
▸ ACE P12821 1/20 0.51

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
SCHEMBL9738069 1.00 FOLH1 (0.60) FOLH1MMP2MMP9SIRT2SIRT1
SCHEMBL11023043 0.88 FOLH1 (0.58) FOLH1MMP2MMP9SIRT2SIRT1
SCHEMBL11024671 0.88 FOLH1 (0.58) FOLH1MMP2MMP9SIRT2SIRT1
SCHEMBL9738257 0.88 FOLH1 (0.61) FOLH1MMP2MMP9SIRT2CPB1
SCHEMBL9738268 0.88 FOLH1 (0.61) FOLH1MMP2MMP9SIRT2CPB1
SCHEMBL12433264 0.88 CTSK (0.51) FOLH1MMP9MMP1MMP3ACE
SCHEMBL4426973 0.88 CTSK (0.51) FOLH1MMP9MMP1MMP3ACE
SCHEMBL9810164 0.85 FOLH1 (0.53) FOLH1MMP2MMP9SIRT2SIRT1
SCHEMBL9810168 0.85 FOLH1 (0.53) FOLH1MMP2MMP9SIRT2SIRT1
SCHEMBL9856603 0.85 SIRT2 (0.52) FOLH1MMP2MMP9SIRT2SIRT1

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
US-5151432-A Cognition activators to improve memory, inhibitors of angiotensin converting enzymes, cardiovascular disorders and learning dysfunction ADIR ET COMPAGNIE (FR) 1992-09-29 — — US disclosed
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