SCHEMBL7814549

SCHEMBL7814549

NC(=O)CC1CCCC1N

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 3/20 0.38
SLC6A11 P48066 3/20 0.38
SLC6A13 Q9NSD5 3/20 0.38
ALOX5 P09917 1/20 0.33
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TACR1 P25103 1/20 0.32
PARP15 Q460N3 1/20 0.30
PARP10 Q53GL7 1/20 0.30
PARP2 Q9UGN5 1/20 0.30

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
SCHEMBL1905412 0.85 ALOX5 (0.38) SLC6A12SLC6A11SLC6A13ALOX5KMT2A
SCHEMBL7739796 0.82 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13THRBMEN1
SCHEMBL7740219 0.82 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13THRBMEN1
SCHEMBL7739792 0.82 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13THRBMEN1
SCHEMBL7740218 0.82 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13THRBMEN1
SCHEMBL30445198 0.82 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13THRBMEN1
SCHEMBL3109773 0.82 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13THRBMEN1
SCHEMBL1905506 0.80 ALOX5 (0.38) SLC6A12SLC6A11SLC6A13ALOX5KMT2A
SCHEMBL24260428 0.80 SLC6A12 (0.37) SLC6A12SLC6A11SLC6A13THRBMEN1
SCHEMBL5499821 0.77 CA1 (0.40) ALOX5TACR1

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
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
CN-1307565-A Quinolones used as MRS inhibitor and bactericides SMITHKLINE BEECHAM PLC (GB) 2001-08-08 CN 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