SCHEMBL23344142

SCHEMBL23344142

CCCNC(=O)CCC(NC(=O)CCCCCCCCCCCCCCCCC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.49
▸ NOD1 Q9Y239 6/20 0.44
▸ POLB P06746 1/20 0.44
▸ GLP1R P43220 8/20 0.40
▸ GAA P10253 1/20 0.40
▸ BCHE P06276 1/20 0.39
▸ ACHE P22303 1/20 0.39

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
SCHEMBL12982012 1.00 KMT2A (0.49) KMT2ANOD1POLBGLP1RGAA
SCHEMBL25581112 0.95 KMT2A (0.49) KMT2ANOD1POLBGLP1R
SCHEMBL29551974 0.93 NOD1 (0.48) KMT2ANOD1GLP1R
SCHEMBL29552079 0.89 KMT2A (0.45) KMT2ANOD1POLBGLP1R
SCHEMBL29551996 0.88 KMT2A (0.44) KMT2ANOD1POLBGLP1R
SCHEMBL29552983 0.88 NOD1 (0.52) KMT2ANOD1GLP1R
SCHEMBL26288436 0.87 KMT2A (0.52) KMT2ANOD1POLBGAA
SCHEMBL28832953 0.87 KMT2A (0.50) KMT2ANOD1POLB
SCHEMBL22562639 0.85 KMT2A (0.44) KMT2ANOD1POLBGLP1R
SCHEMBL1891728 0.85 KMT2A (0.50) KMT2ANOD1POLB

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-3819308-A1 PROCESS FOR THE MANUFACTURE OF DERIVATIZED AMINO ACIDS Fresenius Kabi iPSUM S.r.l. (IT) 2021-05-12 — — EP disclosed
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