SCHEMBL9348762

SCHEMBL9348762

CC(NC(=O)CNC(=O)C(N)C(C)C)C(=O)NC(CCC(=O)O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 8/20 0.43
▸ NAALAD2 Q9Y3Q0 2/20 0.43
▸ RIMKLA Q8IXN7 1/20 0.43
▸ BACE1 P56817 4/20 0.41
▸ NOD1 Q9Y239 1/20 0.39
▸ GLO1 Q04760 1/20 0.38
▸ CTSD P07339 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
SCHEMBL9348776 1.00 FOLH1 (0.43) FOLH1NAALAD2RIMKLABACE1NOD1
SCHEMBL29351135 0.89 GNPAT (0.45) FOLH1NAALAD2RIMKLABACE1NOD1
SCHEMBL30930177 0.89 GLO1 (0.42) FOLH1NAALAD2RIMKLABACE1NOD1
SCHEMBL29352968 0.88 FOLH1 (0.41) FOLH1NAALAD2RIMKLANOD1GLO1
SCHEMBL31332141 0.88 FOLH1 (0.41) FOLH1NAALAD2RIMKLANOD1GLO1
SCHEMBL30590545 0.86 FOLH1 (0.50) FOLH1NAALAD2RIMKLABACE1NOD1
SCHEMBL30906691 0.85 BACE1 (0.46) FOLH1BACE1CTSD
SCHEMBL29630420 0.84 BACE1 (0.52) FOLH1NAALAD2RIMKLABACE1CTSD
SCHEMBL29605022 0.83 BACE1 (0.49) BACE1CTSD
SCHEMBL9622060 0.83 FOLH1 (0.56) FOLH1NAALAD2RIMKLANOD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5376356-A Imaging tissue sites of inflammation NEORX CORPORATION (US) 1994-12-27 — — US disclosed
US-5100378-A Lymph cells, infusion and blocking agents NEORX CORPORATION (US) 1992-03-31 — — US disclosed
EP-0463116-A4 IMAGING TISSUE SITES OF INFLAMMATION — 1992-02-19 — — EP disclosed
EP-0463116-A1 IMAGING TISSUE SITES OF INFLAMMATION NEORX CORPORATION (US) 1992-01-02 — — EP disclosed
US-4986979-A Imaging tissue sites of inflammation NEORX CORPORATION 1991-01-22 — — US disclosed
WO-1990010463-A1 IMAGING TISSUE SITES OF INFLAMMATION NEORX CORPORATION (US) 1990-09-20 — — WO disclosed
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