SCHEMBL6000158

SCHEMBL6000158

O=c1oc2c(-c3ccc(Cl)cc3Cl)cc(O)cc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
POLB P06746 3/20 0.51
ALDH1A1 P00352 3/20 0.51
CTDSP1 Q9GZU7 1/20 0.51
ABCB1 P08183 1/20 0.43
MAOA P21397 3/20 0.39
MAOB P27338 3/20 0.39
HPGD P15428 2/20 0.39
CA2 P00918 1/20 0.39
ALPI P09923 1/20 0.39
ALPG P10696 1/20 0.39
HTT P42858 1/20 0.39
XDH P47989 1/20 0.35
MAPK1 P28482 2/20 0.35
BLM P54132 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ESR1 P03372 6/20 0.34
ESR2 Q92731 4/20 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
SCHEMBL6000098 0.89 MAPT (0.54) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL6001366 0.83 MAPT (0.68) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL6001607 0.80 MAPT (0.72) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL6000117 0.78 MAPT (0.69) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL5331356 0.76 MAPT (0.50) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL5307613 0.71 MAPT (0.68) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL31196638 0.71 MAPT (0.68) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL6000106 0.71 MAPT (0.77) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL6002064 0.71 MAPT (0.73) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL6001557 0.70 MAPT (0.67) MAPTMEN1KMT2APOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060234987-A1 Neuroprotective benzo 1 3 oxathiol 2 ones JAQUITH JAMES B 2006-10-19 US claimed
WO-2005012281-A1 NEUROPROTECTIVE BENZO[1,3]OXATHOL-2-ONES AEGERA THERAPEUTICS INC. (CA) 2005-02-10 WO claimed
US-20060234987-A1 Neuroprotective benzo 1 3 oxathiol 2 ones JAQUITH JAMES B 2006-10-19 US disclosed
WO-2005012281-A1 NEUROPROTECTIVE BENZO[1,3]OXATHOL-2-ONES AEGERA THERAPEUTICS INC. (CA) 2005-02-10 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-20060234987-A1 Neuroprotective benzo 1 3 oxathiol 2 ones NLN, SMN1; SMN2, TXN2 MAPT 204/4885MEN1 4526/4885KMT2A 4306/4885

“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.