SCHEMBL4636044

SCHEMBL4636044

CNc1ccc(-c2nc3ccc(C#N)cc3s2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 17/20 1.00
▸ MAPT P10636 2/20 0.67
▸ SNCA P37840 1/20 0.67
▸ SULT1A1 P50225 1/20 0.65
▸ MEN1 O00255 1/20 0.59
▸ GLA P06280 1/20 0.59
▸ GAA P10253 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ CSNK1D P48730 1/20 0.51
▸ CSNK1G2 P78368 1/20 0.51

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
SCHEMBL1638231 0.85 APP (0.74) APPMAPTSNCAMEN1GLA
SCHEMBL24332359 0.84 APP (0.78) APPMAPTSNCASULT1A1MEN1
SCHEMBL13816575 0.82 APP (0.74) APPMAPTSULT1A1MEN1GLA
SCHEMBL28868335 0.81 APP (0.74) APPMAPTMEN1GLAGAA
SCHEMBL24038224 0.81 APP (0.72) APPMAPTSULT1A1GLAGAA
SCHEMBL24332463 0.80 APP (0.72) APPMAPTSULT1A1MEN1GLA
SCHEMBL2628262 0.80 APP (1.00) APPMAPTSNCASULT1A1MEN1
SCHEMBL178156 0.80 APP (1.00) APPMAPTSNCASULT1A1MEN1
SCHEMBL12207349 0.79 APP (1.00) APPMAPTSNCASULT1A1MEN1
SCHEMBL21043888 0.79 APP (0.72) APPMAPTSNCASULT1A1MEN1

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
US-20080305040-A1 In Vivo or in Vitro Method For Detecting Amyloid Deposits Having at Least One Amyloidogenic Protein UNIVERSITY OF PITTSBURGH 2008-12-11 — — US disclosed
EP-1937260-A2 IN-VIVO AND IN-VITRO METHOD FOR DETECTING AMYLOID DEPOSITS HAVING AT LEAST ONE AMYLOIDOGENIC PROTEIN University of Pittsburgh (US) 2008-07-02 — — EP disclosed
WO-2007035405-A2 IN-VIVO AND IN-VITRO METHOD FOR DETECTING AMYLOID DEPOSITS HAVING AT LEAST ONE AMYLOIDOGENIC PROTEIN UNIVERSITY OF PITTSBURGH (US) 2007-03-29 — — 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-20080305040-A1 In Vivo or in Vitro Method For Detecting Amyloid Deposits Having at Least One Amyloidogenic Protein TTR, APBA1, APP APP 3/4885MAPT 214/4885SNCA 1471/4885

“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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