SCHEMBL9015874

SCHEMBL9015874

NCC(=O)NCC(=O)NC(CCC(N)=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
CA2 P00918 5/20 0.42
CA1 P00915 4/20 0.42
FOLH1 Q04609 3/20 0.41
RIMKLA Q8IXN7 1/20 0.41
NAALAD2 Q9Y3Q0 1/20 0.41
GNPAT O15228 1/20 0.40
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
NOD1 Q9Y239 3/20 0.39
SLC6A5 Q9Y345 1/20 0.37
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
TERT O14746 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
SCHEMBL4170252 1.00 KMT2A (0.43) KMT2ACA2CA1FOLH1RIMKLA
SCHEMBL31465332 0.98 KMT2A (0.43) KMT2ACA2CA1FOLH1RIMKLA
SCHEMBL29613144 0.98 KMT2A (0.43) KMT2ACA2CA1FOLH1RIMKLA
SCHEMBL16418501 0.98 KMT2A (0.43) KMT2ACA2CA1FOLH1RIMKLA
SCHEMBL29349975 0.89 FOLH1 (0.55) CA2CA1FOLH1RIMKLANAALAD2
SCHEMBL150160 0.88 KMT2A (0.49) KMT2ACA2CA1FOLH1RIMKLA
SCHEMBL268801 0.88 KMT2A (0.49) KMT2ACA2CA1FOLH1RIMKLA
SCHEMBL27604132 0.88 KMT2A (0.49) KMT2ACA2CA1FOLH1RIMKLA
SCHEMBL29539031 0.87 QRFPR (0.43) KMT2ACA2CA1NOD1MMP2
SCHEMBL30078713 0.87 FOLH1 (0.53) FOLH1RIMKLANAALAD2GNPAT

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-5573748-A KIT FOR USE IN PREPARING THE CHELATE; CONTAINER WITH GLYCYLGLYCYL LIGAND, WATER SOLUBLE STANNOUS SALT, INTERMEDIATE EXCHANGE LIGAND, WATER SOLUBLE TECHNETIUM-99M PERTECHNETATE UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 1996-11-12 US disclosed
US-5322929-A Tri- and tetrapeptides as ligands UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 1994-06-21 US disclosed
US-4980147-A INJECTING AS IMAGING AGENTS IN SCINTIGRAPHIC UROGRAPHY UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 1990-12-25 US disclosed
EP-0173424-A1 Radiolabeled technetium chelates for use in renal function determinations UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 1986-03-05 EP disclosed