SCHEMBL7812693

SCHEMBL7812693

COc1cc(NCCCCN)nc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.61
RAD52 P43351 1/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALOX15 P16050 1/20 0.45
ACHE P22303 5/20 0.44

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
SCHEMBL7805481 0.99 SLC2A1 (0.60) SLC2A1RAD52KDM4ELMNAHPGD
SCHEMBL6607915 0.96 SLC2A1 (0.62) SLC2A1RAD52KDM4ELMNAHPGD
Hydrochloric Acid SCHEMBL6607447 0.95 SLC2A1 (0.61) SLC2A1RAD52KDM4ELMNAHPGD
SCHEMBL7805302 0.83 NCF1 (0.48) SLC2A1KDM4EHPGDSMN1; SMN2
SCHEMBL6607938 0.80 SLC2A1 (0.62) SLC2A1RAD52KDM4ELMNAHPGD
SCHEMBL6619693 0.79 SLC2A1 (0.61) SLC2A1RAD52KDM4ELMNAHPGD
SCHEMBL7818347 0.78 SLC2A1 (0.63) SLC2A1RAD52KDM4ELMNAHPGD
SCHEMBL7815368 0.77 KDM4E (0.54) SLC2A1RAD52KDM4EHPGDSMN1; SMN2
SCHEMBL7805323 0.77 SLC2A1 (0.69) SLC2A1RAD52KDM4ELMNAHPGD
SCHEMBL7805110 0.77 SLC2A1 (0.62) SLC2A1RAD52KDM4ELMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6320051-B1 AMINO(NH) OR OXYGEN(O) SUBSTITUTED, ENZYME INHIBITORS OF STAPHLOCCOCUS AUREUS METHIONYL T-RNA SYNTHETASE (MRS); ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM PLC (GB) 2001-11-20 US disclosed
EP-1084110-A1 QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES SMITHKLINE BEECHAM PLC (GB) 2001-03-21 EP disclosed
WO-1999055677-A1 QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES SMITHKLINE BEECHAM PLC (GB) 1999-11-04 WO disclosed