SCHEMBL7546447

SCHEMBL7546447

OCCNc1ccnc(-c2cccc(-c3ccccn3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
CCR1 P32246 3/20 0.51
CCR5 P51681 3/20 0.51
CCR8 P51685 3/20 0.51
LMNA P02545 2/20 0.51
MAPK1 P28482 2/20 0.51
TP53 P04637 1/20 0.51
ALPL P05186 1/20 0.51
HSP90AA1 P07900 1/20 0.51
ALPI P09923 1/20 0.51
ALPG P10696 1/20 0.51
ALOX15 P16050 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
CHRM1 P11229 1/20 0.46
ADRA1D P25100 1/20 0.46

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
SCHEMBL7551921 0.90 CCR1 (0.51) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL7548609 0.79 GPR39 (0.44) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL308968 0.74 HSP90AA1 (0.43) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL7546716 0.74 CCR1 (0.56) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL308214 0.73 KDM4E (0.47) KDM4ESMN1; SMN2KDM6BKDM4AKDM5C
Terpyridine SCHEMBL30610403 0.72 KDM4E (0.90) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL57442 0.72 KDM4E (1.00) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL7964803 0.72 KDM4E (1.00) KDM4ECCR1CCR5CCR8LMNA
Terpyridine SCHEMBL29357603 0.72 KDM4E (1.00) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL30172832 0.72 KDM4E (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885233-B1 TERPYRIDINE-PLATINUM(II) COMPLEXES ISIS INNOVATION (GB) 2002-06-19 EP disclosed