SCHEMBL13086766

SCHEMBL13086766

Nc1c(/N=N/c2ccc(-c3ccc(/N=N/c4cc(S(=O)(=O)O)c5ccccc5c4N)cc3)cc2)cc(SOOO)c2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.73
▸ MEN1 O00255 1/20 0.73
▸ ALDH1A1 P00352 1/20 0.73
▸ MAPT P10636 1/20 0.73
▸ THRB P10828 1/20 0.73
▸ HPGD P15428 1/20 0.73
▸ ALOX12 P18054 1/20 0.73
▸ SNCA P37840 1/20 0.73
▸ RECQL P46063 1/20 0.73
▸ BLM P54132 1/20 0.73
▸ KMT2A Q03164 1/20 0.73
▸ TDP1 Q9NUW8 1/20 0.73
▸ SLC7A11 Q9UPY5 5/20 0.63
▸ SENP2 Q9HC62 4/20 0.63
▸ SENP1 Q9P0U3 4/20 0.63
▸ SUMO2 P61956 3/20 0.63
▸ SUMO1 P63165 3/20 0.63
▸ SENP7 Q9BQF6 3/20 0.63
▸ ENPP2 Q13822 2/20 0.56
▸ GLB1 P16278 1/20 0.56

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
SCHEMBL12534464 1.00 APP (0.73) APPMEN1ALDH1A1MAPTTHRB
SCHEMBL12534467 0.87 SENP2 (0.60) APPMEN1ALDH1A1MAPTTHRB
SCHEMBL12534470 0.86 APP (0.54) APPMEN1ALDH1A1MAPTTHRB
Congo Red Free Acid SCHEMBL2583894 0.86 APP (1.00) APPMEN1ALDH1A1MAPTTHRB
Congo Red Free Acid SCHEMBL29825625 0.86 APP (1.00) APPMEN1ALDH1A1MAPTTHRB
Congo Red Free Acid SCHEMBL1254806 0.86 APP (1.00) APPMEN1ALDH1A1MAPTTHRB
Congo Red Free Acid SCHEMBL29350758 0.86 APP (1.00) APPMEN1ALDH1A1MAPTTHRB
SCHEMBL12534465 0.85 PHLPP2 (0.54) APPMEN1ALDH1A1MAPTTHRB
Congo Red Free Acid SCHEMBL17272057 0.84 APP (0.97) APPMEN1ALDH1A1MAPTTHRB
Congo Red Free Acid SCHEMBL326268 0.84 APP (0.97) APPMEN1ALDH1A1MAPTTHRB

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-8497260-B2 2-arylbenzothiophene derivatives or pharmaceutically acceptable salts thereof, preparation method thereof, and pharmaceutical composition for the diagnosis or treatment of degenerative brain disease containing the same as active ingredient Industry-University Cooperation Foundation Sogang University (KR) 2013-07-30 — — US disclosed
US-20100261727-A1 2-ARYLBENZOTHIOPHENE DERIVATIVES OR PHARCEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARCEUTICAL COMPOSITION FOR THE DIAGNOSIS OR TREATMENT OF DEGENERATIVE BRAIN DISEASE CONTAINING THE SAME AS ACTIVE INGREDIENT Industry-University Cooperation Foundation Sogang University 2010-10-14 — — US 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-20100261727-A1 2-ARYLBENZOTHIOPHENE DERIVATIVES OR PHARCEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARCEUTICAL COMPOSITION FOR THE DIAGNOSIS OR TREATMENT OF DEGENERATIVE BRAIN DISEASE CONTAINING THE SAME AS ACTIVE INGREDIENT APP, PSEN1, PSEN2 APP 1/4885MEN1 3443/4885ALDH1A1 3155/4885

“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.

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