SCHEMBL8671928

SCHEMBL8671928

O=[C]CC1CC(c2ccc(NC=O)cc2)=NO1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 13/20 0.45
▸ F2 P00734 2/20 0.45
▸ F10 P00742 2/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.44
▸ PRSS1 P07477 1/20 0.40

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
SCHEMBL14214320 0.68 ALDH1A1 (0.47) MIF
SCHEMBL8250520 0.63 ALDH1A1 (0.46) MIFHDAC6
SCHEMBL3986368 0.62 F2 (0.44) MIFF2F10HDAC6
SCHEMBL455228 0.61 MIF (1.00) MIFHDAC6
SCHEMBL667764 0.61 MIF (1.00) MIFHDAC6
SCHEMBL8243017 0.61 MIF (0.52) MIFHDAC6
SCHEMBL12556024 0.61 MIF (0.76) MIFHDAC6
Vgx-1027 SCHEMBL1404343 0.61 MIF (0.78) MIFHDAC6
Vgx-1027 SCHEMBL1414048 0.61 MIF (0.78) MIFHDAC6
SCHEMBL469386 0.61 ALDH1A1 (0.72) —

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-0832076-A1 NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-04-01 — — EP claimed
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