SCHEMBL7215547

SCHEMBL7215547

COC(=O)c1cc(=O)n2cc(OCCCCNC(=O)OC(C)(C)C)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 5/20 0.49
▸ CA1 P00915 5/20 0.49
▸ CA2 P00918 5/20 0.49
▸ CA9 Q16790 5/20 0.49
▸ SUCNR1 Q9BXA5 7/20 0.42
▸ BRD4 O60885 2/20 0.40
▸ MGLL Q99685 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ DYRK1A Q13627 1/20 0.38

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
SCHEMBL7222073 0.97 CA12 (0.48) CA12CA1CA2CA9SUCNR1
SCHEMBL7222068 0.94 CA12 (0.47) CA12CA1CA2CA9SUCNR1
SCHEMBL7216544 0.91 CA12 (0.50) CA12CA1CA2CA9SUCNR1
SCHEMBL7217838 0.88 CA12 (0.49) CA12CA1CA2CA9SUCNR1
SCHEMBL7216596 0.85 CA12 (0.48) CA12CA1CA2CA9SUCNR1
SCHEMBL7216494 0.83 CA12 (0.45) CA12CA1CA2CA9SUCNR1
SCHEMBL15856116 0.80 CA12 (0.66) CA12CA1CA2CA9SUCNR1
SCHEMBL7217967 0.79 NAMPT (0.40) CA1CA2BRD4
SCHEMBL24363493 0.79 CA12 (0.57) CA12CA1CA2CA9SUCNR1
SCHEMBL7217945 0.77 CA12 (0.47) CA12CA1CA2CA9SUCNR1

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-6630488-B1 Quinolizinones as integrin inhibitors BIOCHEM PHARMA, INC. (CA) 2003-10-07 — — US disclosed
EP-1115724-A1 QUINOLIZINONES AS INTEGRIN INHIBITORS Shire Biochem Inc. (CA) 2001-07-18 — — EP disclosed
WO-2000017197-A1 QUINOLIZINONES AS INTEGRIN INHIBITORS BIOCHEM PHARMA INC. (US) 2000-03-30 — — WO disclosed
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