SCHEMBL5139610

SCHEMBL5139610

C[n+]1ccccc1-c1c2nc(cc3ccc(cc4nc(cc5ccc1[nH]5)C=C4)[nH]3)C=C2

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.54
▸ STAT1 P42224 1/20 0.54
▸ TERT O14746 5/20 0.37

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
SCHEMBL3803641 0.85 STAT3 (0.51) STAT3STAT1TERT
SCHEMBL450416 0.81 TERT (0.54) TERT
SCHEMBL5139609 0.81 STAT3 (0.36) STAT3STAT1
SCHEMBL29469529 0.81 STAT3 (0.36) STAT3STAT1
SCHEMBL6007193 0.81 STAT3 (0.49) STAT3STAT1TERT
SCHEMBL17668308 0.80 TERT (0.53) TERT
Hydrochloric Acid SCHEMBL2555721 0.80 TERT (0.53) TERT
Hydrochloric Acid SCHEMBL5150601 0.79 STAT3 (0.47) STAT3STAT1TERT
Hydrochloric Acid SCHEMBL2553046 0.79 TERT (0.52) TERT
Hydrochloric Acid SCHEMBL2555716 0.79 TERT (0.52) TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207582-A1 Substituted Porphyrins DUKE UNIVERSITY (US) 2008-08-28 — — US disclosed
US-20070179124-A1 Substituted Porphyrins FRIDOVICH IRWIN 2007-08-02 — — US disclosed
US-20060074062-A1 Substituted porphyrins DUKE UNIVERSITY (US) 2006-04-06 — — US disclosed
US-6916799-B2 Substituted porphyrins DUKE UNIVERSITY (US) 2005-07-12 — — US disclosed
EP-1045851-B1 SUBSTITUTED PORPHYRINS UNIV DUKE (US) 2003-04-23 — — EP 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 (3 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-20070179124-A1 Substituted Porphyrins PPOX, GPX4, PRDX5 STAT3 892/4885STAT1 1589/4885TERT 821/4885
US-20080207582-A1 Substituted Porphyrins SOD3, MPO, SOD1 STAT3 1497/4885STAT1 1104/4885TERT 1398/4885
US-20060074062-A1 Substituted porphyrins PPOX, GPX4, PRDX5 STAT3 892/4885STAT1 1589/4885TERT 821/4885

“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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