SCHEMBL30544860

SCHEMBL30544860

NCCCC[C@H](NC(=O)n1ccnn1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 1/20 0.47
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ SLC15A2 Q16348 1/20 0.38
▸ SLC6A5 Q9Y345 1/20 0.38
▸ CPB2 Q96IY4 5/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ GSR P00390 1/20 0.36
▸ RNPEP Q9H4A4 1/20 0.35
▸ NAALAD2 Q9Y3Q0 1/20 0.34

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
SCHEMBL30544859 1.00 FOLH1 (0.47) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL30544854 0.77 FOLH1 (0.51) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL30544869 0.74 FOLH1 (0.42) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL43996 0.70 FOLH1 (0.66) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL9875634 0.70 FOLH1 (0.66) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL43995 0.70 FOLH1 (0.66) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL12572609 0.70 FOLH1 (0.83) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL1006178 0.69 FOLH1 (0.64) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL1006179 0.69 FOLH1 (0.64) FOLH1CA1CA2SLC15A2SLC6A5
SCHEMBL5497824 0.69 FOLH1 (0.64) FOLH1CA1CA2SLC15A2SLC6A5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4496837-A2 ORTHOGONALLY CROSSLINKED PROTEINS, METHODS OF MAKING, AND USES THEREOF The Research Foundation for The State University of New York (US) 2025-01-29 — — EP disclosed
WO-2023178107-A2 ORTHOGONALLY CROSSLINKED PROTEINS, METHODS OF MAKING, AND USES THEREOF THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-09-21 — — WO disclosed
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