SCHEMBL7294147

SCHEMBL7294147

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.55
▸ SIRT1 Q96EB6 1/20 0.55
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ TLR2 O60603 2/20 0.44
▸ FOLH1 Q04609 1/20 0.44
▸ ITGB3 P05106 4/20 0.41
▸ ITGA2B P08514 4/20 0.41
▸ PAOX Q6QHF9 2/20 0.41
▸ CHRM2 P08172 1/20 0.40
▸ CHRM4 P08173 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ GNPAT O15228 1/20 0.39
▸ CPA1 P15085 1/20 0.39
▸ CPA2 P48052 1/20 0.39
▸ CPA4 Q9UI42 1/20 0.39
▸ GSR P00390 1/20 0.38
▸ SLC6A5 Q9Y345 1/20 0.38
▸ RNPEP Q9H4A4 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37

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
SCHEMBL20435077 0.85 SIRT6 (0.58) SIRT6SIRT1CA1CA2TLR2
SCHEMBL12749404 0.85 SIRT6 (0.58) SIRT6SIRT1CA1CA2TLR2
SCHEMBL20435058 0.85 SIRT6 (0.58) SIRT6SIRT1CA1CA2TLR2
SCHEMBL726302 0.83 SIRT6 (0.56) SIRT6SIRT1CA1CA2TLR2
SCHEMBL20529 0.83 FOLH1 (0.62) SIRT6SIRT1CA1CA2TLR2
SCHEMBL919220 0.83 FOLH1 (0.62) SIRT6SIRT1CA1CA2TLR2
SCHEMBL11896083 0.83 SIRT6 (0.56) SIRT6SIRT1CA1CA2TLR2
SCHEMBL20530 0.83 FOLH1 (0.62) SIRT6SIRT1CA1CA2TLR2
SCHEMBL16238796 0.81 FOLH1 (0.60) SIRT6SIRT1CA1CA2TLR2
Hydrochloric Acid SCHEMBL15669796 0.81 FOLH1 (0.60) SIRT6SIRT1CA1CA2TLR2

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-0343911-A2 Cycloalkyl-substituted glutaramide diuretic agents Pfizer Limited (GB) 1989-11-29 — — EP claimed
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