SCHEMBL8865508

SCHEMBL8865508

NCc1cccc(-c2c3nc(c(-c4cccc(CN)c4)c4ccc([nH]4)c(-c4cccc(CN)c4)c4nc(c(-c5cccc(CN)c5)c5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 5/20 0.46
▸ TOP1 P11387 2/20 0.44
▸ STAT3 P40763 1/20 0.43
▸ STAT1 P42224 1/20 0.43
▸ CYCS P99999 3/20 0.42
▸ CDK8 P49336 1/20 0.42
▸ ENPP2 Q13822 1/20 0.41
▸ CHEK1 O14757 1/20 0.40
▸ WEE1 P30291 1/20 0.40

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
SCHEMBL4266268 0.85 TERT (0.46) TERTTOP1STAT3STAT1CYCS
SCHEMBL3999476 0.85 TOP1 (0.54) TERTTOP1STAT3STAT1CYCS
SCHEMBL4268731 0.85 TERT (0.46) TERTTOP1STAT3STAT1CYCS
SCHEMBL1639281 0.81 TOP1 (0.50) TERTTOP1STAT3STAT1CYCS
SCHEMBL8865610 0.81 MMP3 (0.46) TERTTOP1STAT3STAT1CYCS
SCHEMBL5918884 0.80 TOP1 (0.55) TERTTOP1STAT3STAT1CYCS
SCHEMBL30493184 0.80 TOP1 (0.55) TERTTOP1STAT3STAT1CYCS
SCHEMBL8909228 0.79 GRIN2D (0.53) TERTTOP1STAT3STAT1CYCS
SCHEMBL8908306 0.79 TOP1 (0.48) TERTTOP1STAT3STAT1CYCS
SCHEMBL1640460 0.79 TERT (0.50) TERTTOP1STAT3STAT1CYCS

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
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
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
US-5217966-A Synthetic drug molecules that mimic metalloenzymes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1993-06-08 — — US disclosed
US-5202317-A SYNTHETIC DRUG MOLECULES THAT MIMIC METALLOENZYMES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1993-04-13 — — US disclosed
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