SCHEMBL29639754

SCHEMBL29639754

NCCCC[C@H](NC(=O)CNC(=O)c1ccc(O)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 4/20 0.52
ERAP2 Q6P179 3/20 0.52
FOLH1 Q04609 13/20 0.49
HPGDS O60760 1/20 0.49
ERAP1 Q9NZ08 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
SLC6A5 Q9Y345 1/20 0.44

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
SCHEMBL6277441 0.90 GPR139 (0.52) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL2464334 0.90 GPR139 (0.52) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL1009379 0.90 GPR139 (0.52) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL7034241 0.87 LNPEP (0.60) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL7034236 0.87 LNPEP (0.60) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL29683438 0.83 C3AR1 (0.59) LNPEPERAP1CA2SLC6A5
SCHEMBL9716717 0.83 ERAP2 (0.55) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL9716722 0.83 ERAP2 (0.55) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL9716730 0.83 ERAP2 (0.55) LNPEPERAP2FOLH1HPGDSERAP1
SCHEMBL31236824 0.80 LNPEP (0.62) LNPEPERAP2

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
CN-117925887-A InDel molecular marker for identifying powdery mildew resistance trait of muskmelon and application thereof 宿迁市绿港现代农业研究院有限公司 2024-04-26 CN disclosed
EP-4263809-A1 DOPAMINERGIC NEURON PROGENITOR CELLS OR CELL DERIVATIVES THEREOF OBTAINED FROM LINEAGE RESTRICTED PLURIPOTENT STEM CELLS Aarhus Universitet (DK) 2023-10-25 EP disclosed
WO-2022136306-A1 DOPAMINERGIC NEURON PROGENITOR CELLS OR CELL DERIVATIVES THEREOF OBTAINED FROM LINEAGE RESTRICTED PLURIPOTENT STEM CELLS AARHUS UNIVERSITET (DK) 2022-06-30 WO disclosed