SCHEMBL13058005

SCHEMBL13058005

O=C(ON1C(=O)CCC1=O)c1ccc2c(c1)C1(OC2=O)c2ccc(Br)cc2Oc2cc(Br)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 8/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.41
PRMT1 Q99873 2/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
SMAD3 P84022 1/20 0.41
ACE2 Q9BYF1 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.37
GSTP1 P09211 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 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
SCHEMBL31580193 0.89 FTO (0.55) FTOMEN1MAPTHTTKMT2A
SCHEMBL334086 0.89 FTO (0.55) FTOMEN1MAPTHTTKMT2A
SCHEMBL29383733 0.89 FTO (0.55) FTOMEN1MAPTHTTKMT2A
SCHEMBL20340166 0.86 MEN1 (0.41) FTOMEN1MAPTHTTKMT2A
SCHEMBL29579867 0.86 FTO (0.55) FTOMEN1MAPTHTTKMT2A
SCHEMBL18512417 0.85 MEN1 (0.39) FTOMEN1MAPTHTTKMT2A
SCHEMBL30463695 0.85 MAPT (0.62) FTOMEN1MAPTHTTKMT2A
SCHEMBL14837062 0.85 MAPT (0.62) FTOMEN1MAPTHTTKMT2A
SCHEMBL30445183 0.85 MAPT (0.62) FTOMEN1MAPTHTTKMT2A
SCHEMBL29373139 0.85 MAPT (0.62) FTOMEN1MAPTHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842823-B2 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-11-30 US disclosed
US-7842823-B2 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-11-30 US disclosed
US-20070141658-A1 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-21 US disclosed
US-20070141658-A1 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-21 US disclosed
WO-2007050810-A2 FLUOROGENIC PROBES FOR REACTIVE OXYGEN SPECIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-05-03 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-20070141658-A1 Fluorogenic probes for reactive oxygen species PRDX1, GPX1, GPX4 FTO 3298/4885MEN1 2037/4885MAPT 3169/4885

“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.