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SCHEMBL10700366

SCHEMBL10700366

CC(=O)Oc1ccc(C(NC(=O)N2CCN(Cc3ccc(O)c(O)c3)C(=O)C2=O)C(=O)N[C@@]2(C(=O)O)N3C(=O)[C@H](NC=O)[C@H]3SC2(C)C)cc1OC(C)=O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CCKBR P32239 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ SLC22A6 Q4U2R8 1/20 0.30
▸ SLC22A8 Q8TCC7 1/20 0.30
▸ SLC22A11 Q9NSA0 1/20 0.30

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
SCHEMBL10700293 0.94 LMNA (0.32) —
SCHEMBL10493034 0.90 MAPT (0.36) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10701799 0.90 MAPT (0.37) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10834483 0.90 MAPT (0.36) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10700405 0.90 — —
SCHEMBL10700846 0.90 MEN1 (0.39) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10493032 0.85 MAPT (0.39) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL11157011 0.85 MAPT (0.39) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10702686 0.85 LMNA (0.31) MEN1KMT2ACCKBR
SCHEMBL10702532 0.84 LMNA (0.35) MEN1KMT2ACCKBRMAPTPDE3A

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-0293532-A1 6- or 7-beta-[2-[4-(substituted)-2,3-dioxopiperazin-1-yl) carbonylamino]-(substituted)acetamido]-penicillin and cephalosporin derivatives BEECHAM GROUP PLC (GB) 1988-12-07 — — EP disclosed
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