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SCHEMBL10700830

SCHEMBL10700830

C[C@H]1C(=S)N2[C@@H]1SC(C)(C)[C@]2(NC(=O)C(NC(=O)N1CCN(Cc2cccc(OCc3ccccc3)c2OCc2ccccc2)C(=O)C1=O)c1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CCKBR P32239 1/20 0.35

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
SCHEMBL10702810 0.89 LMNA (0.34) LMNAMEN1KMT2ACCKBR
SCHEMBL10699762 0.88 LMNA (0.36) LMNAMEN1KMT2ACCKBR
SCHEMBL10699846 0.87 LMNA (0.33) LMNAMEN1KMT2ACCKBR
SCHEMBL10699717 0.85 LMNA (0.34) LMNAMEN1KMT2ACCKBR
SCHEMBL10700881 0.83 LMNA (0.36) LMNAMEN1KMT2ACCKBR
SCHEMBL10702632 0.83 — —
SCHEMBL10699319 0.79 LMNA (0.35) LMNAMEN1KMT2ACCKBR
SCHEMBL10701030 0.78 LMNA (0.34) LMNAMEN1KMT2ACCKBR
SCHEMBL10702663 0.77 LMNA (0.36) LMNAMEN1KMT2ACCKBR
SCHEMBL10809228 0.76 MEN1 (0.38) LMNAMEN1KMT2ACCKBR

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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