SCHEMBL30198445

SCHEMBL30198445

NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.55
PTGS1 P23219 1/20 0.48
GSTK1 Q9Y2Q3 1/20 0.48
RIMKLA Q8IXN7 1/20 0.46
NAALAD2 Q9Y3Q0 1/20 0.46
KMT2A Q03164 2/20 0.45
ALOX15 P16050 1/20 0.45
BLM P54132 1/20 0.45
PMP22 Q01453 1/20 0.45
DPP4 P27487 2/20 0.44
DPP8 Q6V1X1 2/20 0.44
DPP9 Q86TI2 2/20 0.44
GRM8 O00222 1/20 0.42
GRM6 O15303 1/20 0.42
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GSR P00390 1/20 0.42
CYP1A2 P05177 1/20 0.42
GRIK1 P39086 1/20 0.42
GRM5 P41594 1/20 0.42

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
SCHEMBL7461972 1.00 FOLH1 (0.55) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6810612 1.00 FOLH1 (0.55) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6810621 1.00 FOLH1 (0.55) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6809811 0.99 FOLH1 (0.54) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6809803 0.99 FOLH1 (0.54) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL30792478 0.96 FOLH1 (0.54) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6809847 0.96 KMT2A (0.49) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6809858 0.96 KMT2A (0.49) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6806102 0.94 KMT2A (0.47) FOLH1PTGS1GSTK1RIMKLANAALAD2
SCHEMBL6806093 0.94 KMT2A (0.47) FOLH1PTGS1GSTK1RIMKLANAALAD2

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
US-11566256-B2 Polynucleotides and polypeptides in plants MENDEL BIOTECHNOLOGY, INC. (US) 2023-01-31 US disclosed