SCHEMBL10888030

SCHEMBL10888030

CC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)OC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.49
▸ SIRT1 Q96EB6 1/20 0.49
▸ FURIN P09958 8/20 0.45
▸ CA1 P00915 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ TLR2 O60603 2/20 0.43
▸ CPA1 P15085 1/20 0.41
▸ CPA2 P48052 1/20 0.41
▸ CPA4 Q9UI42 1/20 0.41

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
SCHEMBL10888019 0.95 SIRT6 (0.51) SIRT6SIRT1FURINCA1CA2
SCHEMBL30598012 0.83 SIRT6 (0.53) SIRT6SIRT1FURINCA1CA2
SCHEMBL10609149 0.83 SIRT6 (0.53) SIRT6SIRT1FURINCA1CA2
SCHEMBL29398096 0.82 GNPAT (0.53) SIRT6SIRT1FURINCPA1CPA2
SCHEMBL18916659 0.82 SIRT6 (0.57) SIRT6SIRT1FURINCA1CA2
SCHEMBL18916662 0.81 SIRT6 (0.57) SIRT6SIRT1FURINCA1CA2
SCHEMBL29394605 0.80 SIRT6 (0.56) SIRT6SIRT1FURINCA1CA2
SCHEMBL12035292 0.80 FURIN (0.52) SIRT6SIRT1FURINCA1CA2
SCHEMBL29396101 0.79 SIRT6 (0.55) SIRT6SIRT1FURINCA1CA2
SCHEMBL2596551 0.79 FURIN (0.41) SIRT6SIRT1FURINCA1CA2

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-0085667-B1 ENZYMATIC PROCESS FOR THE DETERMINATION OF ANTIBIOTICS CONTAINING A BETA-LACTAM NUCLEUS U C B, S.A. (BE) 1986-05-07 — — EP claimed
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