SCHEMBL13077267

SCHEMBL13077267

BC1=C(B)c2occ(C(=O)c3cc(F)c(OC)c(F)c3)c2C(=O)C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDF Q9HBH1 12/20 0.54
▸ MAPT P10636 4/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.45
▸ HKDC1 Q2TB90 2/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ MEN1 O00255 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CDC25A P30304 1/20 0.40
▸ CDC25B P30305 1/20 0.40
▸ CDC25C P30307 1/20 0.40
▸ MPI P34949 1/20 0.40
▸ NR4A1 P22736 1/20 0.39
▸ USP2 O75604 1/20 0.39

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
SCHEMBL13076502 0.92 PDF (0.53) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL16994938 0.90 PDF (0.62) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL13076844 0.87 PDF (0.55) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL290433 0.83 PDF (0.77) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL805348 0.79 PDF (0.60) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL13076487 0.73 MAPT (0.56) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL16994971 0.71 PDF (0.57) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL16994963 0.71 MAPT (0.47) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL13076493 0.70 MAPT (0.46) PDFMAPTKDM4ENPSR1HKDC1
SCHEMBL290648 0.70 PDF (1.00) PDFMAPTKDM4ENPSR1HKDC1

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
WO-2010129049-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2010-11-11 — — WO disclosed
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