SCHEMBL3465842

SCHEMBL3465842

C[n+]1cccc(-c2c3nc(cc4ccc(cc5nc(cc6ccc2[nH]6)C=C5)[nH]4)C=C3)c1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 6/20 0.65
▸ STAT3 P40763 1/20 0.60
▸ STAT1 P42224 1/20 0.60
▸ ENPP2 Q13822 1/20 0.32
▸ TOP1 P11387 3/20 0.32
▸ CYCS P99999 2/20 0.30

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
Iodide SCHEMBL30767160 0.91 TERT (0.67) TERTSTAT3STAT1ENPP2TOP1
Iodide SCHEMBL20240644 0.91 TERT (0.67) TERTSTAT3STAT1ENPP2TOP1
SCHEMBL4797002 0.85 TERT (0.63) TERTSTAT3STAT1ENPP2TOP1
SCHEMBL30753635 0.82 STAT3 (0.86) TERTSTAT3STAT1ENPP2TOP1
SCHEMBL473158 0.82 STAT3 (0.86) TERTSTAT3STAT1ENPP2TOP1
SCHEMBL869153 0.82 TERT (0.94) TERTSTAT3STAT1ENPP2TOP1
SCHEMBL1275381 0.81 STAT3 (0.84) TERTSTAT3STAT1ENPP2TOP1
SCHEMBL869155 0.79 TERT (0.43) TERTSTAT3STAT1
SCHEMBL2563180 0.79 STAT3 (0.91) TERTSTAT3STAT1ENPP2TOP1
SCHEMBL226835 0.78 STAT3 (0.83) TERTSTAT3STAT1ENPP2TOP1

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
EP-2230242-B1 Synthesis of new asymmetrically meso-substituted water-soluble porphyrins acting as cytostatic agents JOHANNES KEPLER UNI (AT) 2013-08-14 — — EP disclosed
EP-2230242-A1 Synthesis of new asymmetrically meso-substituted water-soluble porphyrins acting as cytostatic agents Johannes Kepler Universität (AT) 2010-09-22 — — EP disclosed
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