SCHEMBL5619154

SCHEMBL5619154

C[C@H](c1ccccc1)N1CC[C@H](C(NC(=O)OC(C)(C)C)c2ccccn2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 3/20 0.39
ADORA2A P29274 2/20 0.39
KMT2A Q03164 1/20 0.39
KDM4D Q6B0I6 2/20 0.38
MAPK1 P28482 1/20 0.37
CTSK P43235 2/20 0.37
SCN9A Q15858 3/20 0.36
GPR119 Q8TDV5 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
ADAM17 P78536 1/20 0.36

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
SCHEMBL5619371 0.85 KMT2A (0.46) ADORA2BADORA2AKMT2AMAPK1CTSK
SCHEMBL5619366 0.85 KMT2A (0.46) ADORA2BADORA2AKMT2AMAPK1CTSK
SCHEMBL5618387 0.84 CTSK (0.37) ADORA2BADORA2AKMT2AMAPK1CTSK
SCHEMBL5618694 0.84 CTSK (0.37) ADORA2BADORA2AKMT2AMAPK1CTSK
SCHEMBL5619488 0.83 ADORA2B (0.39) ADORA2BADORA2AKDM4DCTSKSCN9A
SCHEMBL5619489 0.83 ADORA2B (0.39) ADORA2BADORA2AKDM4DCTSKSCN9A
SCHEMBL5619012 0.82 KMT2A (0.39) KMT2AMAPK1CTSK
SCHEMBL5619497 0.82 KMT2A (0.39) KMT2AMAPK1CTSKSCN9A
SCHEMBL5619494 0.82 KMT2A (0.39) KMT2AMAPK1CTSKSCN9A
SCHEMBL5619552 0.79 KDM4D (0.44) KMT2AKDM4DSCN9A

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
US-7186843-B2 potent antibacterial activity against various bacteria including drug-resistant strains DAIICHI PHARMACEUTICAL CO. LTD. (JP) 2007-03-06 US disclosed