SCHEMBL10702632

SCHEMBL10702632

CC(=O)Oc1ccc(C(NC(=O)N2CCN(Cc3ccc(OCc4ccccc4)c(OCc4ccccc4)c3)C(=O)C2=O)C(=O)N[C@@]2(C(=O)OCc3ccccc3)N3C(=S)[C@@H](C)[C@H]3SC2(C)C)cc1OC(C)=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL10702810 0.93 LMNA (0.34) —
SCHEMBL10699951 0.90 — —
SCHEMBL10702686 0.88 LMNA (0.31) —
SCHEMBL10699717 0.87 LMNA (0.34) —
SCHEMBL10699846 0.84 LMNA (0.33) —
SCHEMBL10699319 0.83 LMNA (0.35) —
SCHEMBL10700881 0.83 LMNA (0.36) —
SCHEMBL10700830 0.83 LMNA (0.35) —
SCHEMBL10701030 0.82 LMNA (0.34) —
SCHEMBL10702663 0.81 LMNA (0.36) —

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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