Terpyridine

Terpyridine

SCHEMBL7790638

OCCS.[Pt].c1ccc(-c2cccc(-c3ccccn3)n2)nc1

nearest known ligand 0.67

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.67
CCR1 P32246 3/20 0.67
CCR5 P51681 3/20 0.67
CCR8 P51685 3/20 0.67
LMNA P02545 3/20 0.67
TP53 P04637 3/20 0.67
ALOX15 P16050 3/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
HTT P42858 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
ALPL P05186 1/20 0.67
HSP90AA1 P07900 1/20 0.67
ALPI P09923 1/20 0.67
ALPG P10696 1/20 0.67
MAPK1 P28482 1/20 0.67
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.52
METAP1 P53582 1/20 0.52
BLM P54132 1/20 0.52

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
2-Mercaptoethanol SCHEMBL7790768 0.85 CCR1 (0.72) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL7112915 0.84 KDM4E (0.95) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL1616654 0.84 KDM4E (0.95) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL30610403 0.82 KDM4E (0.90) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL30172832 0.82 KDM4E (1.00) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL7964803 0.82 KDM4E (1.00) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL57442 0.82 KDM4E (1.00) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL29357603 0.82 KDM4E (1.00) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL7795085 0.81 KDM4E (0.67) KDM4ECCR1CCR5CCR8LMNA
2-Mercaptoethanol SCHEMBL7784953 0.80 CBFB (0.45) KDM4ECCR1CCR5CCR8LMNA

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-1155025-A1 PLATINUM (II) COMPOUNDS ISIS INNOVATION LIMITED (GB) 2001-11-21 EP claimed
WO-2000050431-A1 PLATINUM (II) COMPOUNDS ISIS INNOVATION LIMITED (GB) 2000-08-31 WO claimed
EP-1155025-A1 PLATINUM (II) COMPOUNDS ISIS INNOVATION LIMITED (GB) 2001-11-21 EP disclosed
WO-2000050431-A1 PLATINUM (II) COMPOUNDS ISIS INNOVATION LIMITED (GB) 2000-08-31 WO disclosed