SCHEMBL6508174

SCHEMBL6508174

O=C1OC2(c3ccc(O)cc3Oc3cc(OS(=O)(=O)S)ccc32)c2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 8/20 0.72
MAPT P10636 4/20 0.72
MEN1 O00255 4/20 0.72
KMT2A Q03164 4/20 0.72
TDP1 Q9NUW8 3/20 0.72
HTT P42858 2/20 0.72
HPGD P15428 2/20 0.72
RECQL P46063 2/20 0.72
BLM P54132 2/20 0.72
ACE2 Q9BYF1 2/20 0.72
CYP2C19 P33261 1/20 0.72
SMAD3 P84022 1/20 0.72
PRMT1 Q99873 1/20 0.72
LMNA P02545 3/20 0.59
ALDH1A1 P00352 3/20 0.59
USP2 O75604 2/20 0.59
CYP3A4 P08684 2/20 0.57
GPR55 Q9Y2T6 2/20 0.52
ALOX12 P18054 2/20 0.52
POLB P06746 1/20 0.52

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
SCHEMBL498694 0.90 FTO (0.73) FTOMAPTMEN1KMT2ATDP1
SCHEMBL21638745 0.89 FTO (0.72) FTOMAPTMEN1KMT2ATDP1
SCHEMBL6508177 0.88 FTO (0.70) FTOMAPTMEN1KMT2ATDP1
SCHEMBL19386225 0.87 FTO (0.69) FTOMAPTMEN1KMT2ATDP1
SCHEMBL4663321 0.86 FTO (0.82) FTOMAPTMEN1KMT2ATDP1
SCHEMBL7740798 0.85 FTO (0.81) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL5872682 0.85 FTO (0.89) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL9844354 0.85 FTO (0.89) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL28273623 0.85 FTO (0.89) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL29388667 0.85 FTO (1.00) FTOMAPTMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050250957-A1 Compounds containing thiosulfate moieties MOLECULAR PROBES, INC 2005-11-10 US disclosed
WO-2005047242-A2 COMPOUNDS CONTAINING THIOSULFATE MOIETIES MOLECULAR PROBES, INC. (US) 2005-05-26 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-20050250957-A1 Compounds containing thiosulfate moieties TST, MPST, STS FTO 2910/4885MAPT 2650/4885MEN1 3963/4885

“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.