SCHEMBL10704832

SCHEMBL10704832

CC1(C)S[C@@H]2[C@H](NC(=O)C(NC(=O)N3CCN(Cc4ccc(O)c(O)c4)C(=O)C3=O)c3ccccc3)C(=O)N2[C@H]1C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.68
▸ KMT2A Q03164 2/20 0.68
▸ CCKBR P32239 1/20 0.68
▸ LMNA P02545 2/20 0.59
▸ CA1 P00915 11/20 0.57
▸ CA2 P00918 11/20 0.57
▸ KDM4E B2RXH2 3/20 0.52
▸ RECQL P46063 3/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ TEK Q02763 1/20 0.52
▸ SLC15A2 Q16348 1/20 0.52
▸ TSHR P16473 1/20 0.51

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
SCHEMBL10703173 0.94 LMNA (0.69) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL14506140 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL11908507 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL4486297 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL13788683 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL24437361 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL3233001 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL33894 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL13788684 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1
Piperacillin SCHEMBL10477435 0.87 MEN1 (0.77) MEN1KMT2ACCKBRLMNACA1

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 2 patents. 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 claimed
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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