SCHEMBL13816575

SCHEMBL13816575

N#Cc1ccc2nc(-c3ccc(F)cc3)sc2c1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 15/20 0.74
▸ SULT1A1 P50225 1/20 0.62
▸ KDM4E B2RXH2 2/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ GLA P06280 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ RORC P51449 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MAOB P27338 1/20 0.46

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
SCHEMBL24038172 0.93 APP (0.66) APPSULT1A1KDM4ENPC1GLA
SCHEMBL24332359 0.88 APP (0.78) APPSULT1A1KDM4ENPC1GLA
SCHEMBL24038171 0.86 APP (0.63) APPSULT1A1
SCHEMBL1638231 0.85 APP (0.74) APPKDM4ENPC1GLAGAA
SCHEMBL24038034 0.85 APP (0.59) APPSULT1A1MAOB
SCHEMBL28868335 0.85 APP (0.74) APPKDM4ENPC1GLAGAA
SCHEMBL24038224 0.84 APP (0.72) APPSULT1A1KDM4ENPC1GLA
SCHEMBL24332463 0.84 APP (0.72) APPSULT1A1KDM4ENPC1GLA
SCHEMBL4636044 0.82 APP (1.00) APPSULT1A1GLAGAAMAPT
SCHEMBL24331805 0.81 APP (0.68) APPSULT1A1KDM4ENPC1GLA

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-20090142269-A1 ISOTOYPICALLY-LABELED BENZOTHIAZOLE COMPOUNDS AS IMAGING AGENTS FOR AMYLOIDOGENIC PROTEINS UNIVERSITY OF OITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2009-06-04 — — US disclosed
WO-2007064773-A2 ISOTOPICALLY-LABELED BENZOTHIAZOLE COMPOUNDS AS IMAGING AGENTS FOR AMYLOIDOGENIC PROTEINS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2007-06-07 — — 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-20090142269-A1 ISOTOYPICALLY-LABELED BENZOTHIAZOLE COMPOUNDS AS IMAGING AGENTS FOR AMYLOIDOGENIC PROTEINS MAPT, TSPO, APP APP 3/4885SULT1A1 917/4885KDM4E 4225/4885

“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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