SCHEMBL9830023

SCHEMBL9830023

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)c1ccc(O)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.47
▸ CA1 P00915 2/20 0.47
▸ FOLH1 Q04609 2/20 0.46
▸ GRN P28799 3/20 0.45
▸ SORT1 Q99523 3/20 0.45
▸ CA12 O43570 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ DGAT1 O75907 1/20 0.42
▸ MME P08473 1/20 0.41
▸ PSMB5 P28074 2/20 0.41
▸ CTSL P07711 1/20 0.40

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
SCHEMBL9830000 1.00 CA2 (0.47) CA2CA1FOLH1GRNSORT1
SCHEMBL10660226 0.92 CA2 (0.47) CA2CA1GRNSORT1CA12
SCHEMBL10660207 0.92 CA2 (0.47) CA2CA1GRNSORT1CA12
SCHEMBL9830052 0.92 PSMB5 (0.49) CA2CA1GRNSORT1DGAT1
SCHEMBL9830035 0.92 PSMB5 (0.49) CA2CA1GRNSORT1DGAT1
SCHEMBL316943 0.91 OPRD1 (0.42) FOLH1GRNSORT1
SCHEMBL9409319 0.89 FOLH1 (0.46) FOLH1MMEPSMB5CTSL
SCHEMBL5524927 0.89 FOLH1 (0.41) CA2CA1FOLH1GRNSORT1
SCHEMBL30400489 0.84 NPY4R (0.52) FOLH1
SCHEMBL4671172 0.83 OPRD1 (0.42) CA2CA1FOLH1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 — — EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 — — US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 — — EP disclosed
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