SCHEMBL290558

SCHEMBL290558

Cc1cccc(C(=O)c2coc3c(Br)c(Br)c(O)cc23)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.45
NPC1 O15118 3/20 0.45
PTGS2 P35354 1/20 0.45
POLB P06746 2/20 0.45
SIRT1 Q96EB6 2/20 0.43
KMT2A Q03164 5/20 0.43
MAPT P10636 2/20 0.42
CREBBP Q92793 1/20 0.42
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
CNR2 P34972 1/20 0.40
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
GAA P10253 1/20 0.39
CHEK1 O14757 1/20 0.38
EGFR P00533 1/20 0.38
KDR P35968 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL290323 0.85 PTGS2 (0.56) RAB9ANPC1PTGS2POLBSIRT1
SCHEMBL289028 0.82 SRD5A2 (0.44) RAB9ANPC1PTGS2POLBSIRT1
SCHEMBL290225 0.79 PTGS2 (0.52) RAB9ANPC1PTGS2SIRT1KMT2A
SCHEMBL290073 0.79 PTGS2 (0.52) RAB9ANPC1PTGS2SIRT1KMT2A
SCHEMBL290525 0.78 PDF (0.53) RAB9ANPC1PTGS2POLBSIRT1
SCHEMBL290295 0.78 PTGS2 (0.51) RAB9ANPC1PTGS2SIRT1KMT2A
SCHEMBL289532 0.78 NPC1 (0.57) RAB9ANPC1PTGS2SIRT1KMT2A
SCHEMBL290149 0.77 PTGS2 (0.44) RAB9ANPC1PTGS2SIRT1KMT2A
SCHEMBL299578 0.76 SRD5A2 (0.46) RAB9ANPC1PTGS2POLBKMT2A
SCHEMBL299187 0.76 PTGS2 (0.44) RAB9ANPC1PTGS2POLBKMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2959898-A1 4,5-DIOXO-NAPHTHO[1,2-b]FURANS AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS Sloan-Kettering Institute for Cancer Research (US) 2015-12-30 EP disclosed
EP-2427057-B1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS SLOAN KETTERING INST CANCER (US) 2015-08-12 EP disclosed
US-8614237-B2 Benzofuran-4,5-diones as selective peptide deformylase inhibitors SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2013-12-24 US disclosed
US-20120071523-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2012-03-22 US disclosed
EP-2427057-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS Sloan-Kettering Institute for Cancer Research (US) 2012-03-14 EP disclosed
WO-2010129049-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2010-11-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120071523-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS PDF, EIF5B, EIF4E RAB9A 3434/4885NPC1 1866/4885PTGS2 2098/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.