SCHEMBL12509529

SCHEMBL12509529

COc1ccc2nc(-c3ccc(NC(=O)c4ccc(N=O)cc4C)cc3)sc2c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.55
▸ MAPT P10636 5/20 0.54
▸ TP53 P04637 3/20 0.54
▸ NPC1 O15118 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ MGAM O43451 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ GLA P06280 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ CTSD P07339 1/20 0.47

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
SCHEMBL12509332 0.89 APP (0.59) APPMAPTNPC1RAB9AMGAM
SCHEMBL12422193 0.87 MAPT (0.67) APPMAPTTP53NPC1RAB9A
SCHEMBL12509470 0.85 APP (0.64) APPMAPTTP53NPC1RAB9A
SCHEMBL12509013 0.84 SCD (0.57) APPMAPTTP53NPC1RAB9A
SCHEMBL1985009 0.82 SCD (0.67) APPMAPTTP53NPC1RAB9A
SCHEMBL16623336 0.81 MAPT (0.64) APPMAPTTP53NPC1RAB9A
SCHEMBL12509611 0.81 NPC1 (0.58) APPMAPTNPC1RAB9AMGAM
SCHEMBL10311784 0.81 APP (0.69) APPNPC1RAB9ASMN1; SMN2GLA
SCHEMBL1069914 0.80 MAPT (0.72) APPMAPTTP53NPC1RAB9A
SCHEMBL1993188 0.80 APP (0.58) APPMAPTTP53GLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 — — 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-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES MAPT, PRNP, MAP4 APP 17/4885MAPT 1/4885TP53 94/4885

“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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