SCHEMBL29390540

SCHEMBL29390540

NCCCC[C@H](NN[12C@@H](CCCCN)C(=O)O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 1/20 0.59
▸ GSR P00390 1/20 0.56
▸ RNPEP Q9H4A4 1/20 0.54
▸ CPB2 Q96IY4 10/20 0.48
▸ MMP2 P08253 1/20 0.47
▸ MMP9 P14780 1/20 0.47
▸ SLC6A5 Q9Y345 1/20 0.45
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CYP2D6 P10635 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ GGT1 P19440 1/20 0.40

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
SCHEMBL29894486 1.00 FOLH1 (0.59) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL29669470 0.98 FOLH1 (0.58) FOLH1GSRRNPEPCPB2MMP2
Glycine SCHEMBL15676612 0.94 FOLH1 (0.59) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL29396372 0.93 FOLH1 (0.52) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL29520684 0.92 FOLH1 (0.53) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL29529476 0.90 SLC6A5 (0.54) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL28266171 0.90 FOLH1 (0.56) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL30901213 0.90 SLC6A5 (0.54) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL29511950 0.90 FOLH1 (0.75) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL31207031 0.89 FOLH1 (0.50) FOLH1GSRRNPEPCPB2MMP2

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-3956441-A1 METHANOL UTILIZATION Ginkgo Bioworks, Inc. (US) 2022-02-23 — — EP disclosed
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