SCHEMBL6002082

SCHEMBL6002082

O=c1oc2c(Sc3ccccc3C(F)(F)F)cc(O)cc2s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
PTPN11 Q06124 1/20 0.35
CA2 P00918 1/20 0.35
ALPI P09923 1/20 0.35
ALPG P10696 1/20 0.35
HPGD P15428 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
HTT P42858 1/20 0.35
NOTUM Q6P988 2/20 0.33
PSMB8 P28062 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
KDM4E B2RXH2 2/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL6001582 0.79 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6001403 0.79 MAPT (0.44) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6001395 0.79 MAPT (0.45) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6001574 0.79 MAPT (0.56) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6001597 0.78 MAPT (0.43) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6001549 0.73 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6000104 0.73 MAPT (0.52) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6002117 0.73 MAPT (0.38) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6001499 0.72 MAPT (0.44) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6002056 0.69 MAPT (0.44) MAPTMEN1KMT2AALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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.