SCHEMBL8865323

SCHEMBL8865323

Oc1cccc(-c2c3nc(c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4nc2C=C4)C=C3)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 5/20 0.51
▸ CYCS P99999 3/20 0.51
▸ ENPP2 Q13822 1/20 0.50
▸ TOP1 P11387 2/20 0.49
▸ STAT3 P40763 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ HSD17B1 P14061 1/20 0.43
▸ HSD17B2 P37059 1/20 0.43
▸ RIPK1 Q13546 1/20 0.43

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
SCHEMBL30297908 1.00 TERT (0.51) TERTCYCSENPP2TOP1STAT3
SCHEMBL29648445 1.00 TERT (0.51) TERTCYCSENPP2TOP1STAT3
SCHEMBL29556430 0.98 TOP1 (0.50) TERTCYCSENPP2TOP1STAT3
SCHEMBL31296593 0.98 TOP1 (0.50) TERTCYCSENPP2TOP1STAT3
SCHEMBL249199 0.98 TOP1 (0.50) TERTCYCSENPP2TOP1STAT3
SCHEMBL1640992 0.94 TOP1 (0.54) TERTCYCSENPP2TOP1STAT3
Temoporfin SCHEMBL6422 0.89 TOP1 (0.43) TERTCYCSENPP2TOP1STAT3
SCHEMBL5100886 0.89 TOP1 (0.43) TERTCYCSENPP2TOP1STAT3
SCHEMBL17651778 0.89 TOP1 (0.43) TERTCYCSENPP2TOP1STAT3
SCHEMBL17651811 0.89 TOP1 (0.43) TERTCYCSENPP2TOP1STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0684948-B1 MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME DIAGNOSTIKFORSCHUNG INST (DE) 1997-10-22 — — EP disclosed
US-5674467-A USED IN NMR DIAGNOSIS, RADIODIAGNOSIS OR RADIOTHERAPY INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) 1997-10-07 — — US disclosed
EP-0684948-A1 MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME. DIAGNOSTIKFORSCHUNG INST (DE) 1995-12-06 — — EP disclosed
WO-1994019352-A1 MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 1994-09-01 — — WO disclosed
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