SCHEMBL20528922

SCHEMBL20528922

CC(=O)CNC(CCCCN)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.51
GSR P00390 1/20 0.47
SLC6A5 Q9Y345 1/20 0.47
RNPEP Q9H4A4 1/20 0.46
CPB2 Q96IY4 8/20 0.44
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
GGT1 P19440 1/20 0.42
SIRT6 Q8N6T7 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
PAOX Q6QHF9 2/20 0.41
TLR2 O60603 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 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
SCHEMBL1455718 1.00 FOLH1 (0.51) FOLH1GSRSLC6A5RNPEPCPB2
SCHEMBL8509636 0.88 FOLH1 (0.47) FOLH1GSRSLC6A5RNPEPCPB2
SCHEMBL50111 0.87 FOLH1 (0.57) FOLH1GSRSLC6A5RNPEPCPB2
SCHEMBL43620 0.87 FOLH1 (0.57) FOLH1GSRSLC6A5RNPEPCPB2
SCHEMBL25396641 0.85 FOLH1 (0.51) FOLH1GSRSLC6A5RNPEPCPB2
Water SCHEMBL380638 0.85 FOLH1 (0.56) FOLH1GSRSLC6A5RNPEPCPB2
SCHEMBL20528926 0.85 FOLH1 (0.51) FOLH1GSRSLC6A5RNPEPCPB2
SCHEMBL901403 0.85 FOLH1 (0.56) FOLH1GSRSLC6A5RNPEPCPB2
SCHEMBL380767 0.85 FOLH1 (0.56) FOLH1GSRSLC6A5RNPEPCPB2
Water SCHEMBL28073715 0.85 FOLH1 (0.56) FOLH1GSRSLC6A5RNPEPCPB2

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
US-20230287383-A1 PYRROLYSYL-tRNA SYNTHETASE VARIANTS AND USES THEREOF ENGENES BIOTECH GMBH (AT) 2023-09-14 US claimed
WO-2018185222-A1 AMINOACYL TRNA SYNTHETASES AND ORTHOGONAL TRNAS ACIB GMBH - AUSTRIAN CENTRE OF INDUSTRIAL BIOTECHNOLOGY (AT) 2018-10-11 WO claimed
US-20230287383-A1 PYRROLYSYL-tRNA SYNTHETASE VARIANTS AND USES THEREOF ENGENES BIOTECH GMBH (AT) 2023-09-14 US disclosed