SCHEMBL10700071

SCHEMBL10700071

CC(=O)Oc1ccc(CN2CCN(C(=O)NC(C(=O)O)c3ccccc3)C(=O)C2=O)cc1OC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.37
▸ FAAH O00519 1/20 0.37
▸ CCR5 P51681 1/20 0.37
▸ ATM Q13315 3/20 0.36
▸ KMT2A Q03164 3/20 0.35
▸ BRD4 O60885 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ INSR P06213 1/20 0.34
▸ IGF1R P08069 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ GPR55 Q9Y2T6 1/20 0.34

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
SCHEMBL10701267 0.87 CACNA2D1 (0.37) CCR5
SCHEMBL10700782 0.85 MEN1 (0.43) ATMKMT2AMEN1HTT
SCHEMBL10401867 0.82 TSHR (0.34) POLBGAA
SCHEMBL10700121 0.82 BRD4 (0.36) POLBATMKMT2ABRD4MEN1
SCHEMBL10700196 0.82 TSHR (0.36) POLBATMKMT2AMEN1GAA
SCHEMBL10700025 0.78 POLB (0.39) POLBKMT2ABRD4MEN1INSR
SCHEMBL8597022 0.77 ATM (0.42) POLBATMKMT2AMEN1
SCHEMBL7828421 0.77 ATM (0.42) POLBATMKMT2AMEN1
Water SCHEMBL8600954 0.76 ATM (0.42) POLBATMKMT2AMEN1
SCHEMBL10817522 0.75 POLB (0.34) POLBCCR5KMT2ABRD4MEN1

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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