SCHEMBL25437484

SCHEMBL25437484

N[C@@H](CCCCNC(=O)n1nccn1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GSR P00390 1/20 0.43
▸ OTC P00480 1/20 0.43
▸ ARG1 P05089 4/20 0.40
▸ ARG2 P78540 4/20 0.40
▸ DDAH1 O94760 2/20 0.38
▸ ANPEP P15144 1/20 0.37
▸ DPP7 Q9UHL4 1/20 0.37
▸ NOS3 P29474 2/20 0.36
▸ NOS1 P29475 2/20 0.36
▸ NOS2 P35228 2/20 0.36
▸ NOD1 Q9Y239 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ TSHR P16473 1/20 0.36

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
SCHEMBL34467684 0.77 OTC (0.35) GSROTCARG1DPP7NOS3
SCHEMBL34467664 0.76 NOS1 (0.41) DPP7NOS1
SCHEMBL9875639 0.75 GSR (0.57) GSROTCARG1ARG2DDAH1
SCHEMBL20643482 0.75 GSR (0.57) GSROTCARG1ARG2DDAH1
SCHEMBL357483 0.75 GSR (0.57) GSROTCARG1ARG2DDAH1
SCHEMBL28465369 0.73 GSR (0.55) GSROTCARG1ARG2DDAH1
SCHEMBL9069162 0.73 GSR (0.55) GSROTCARG1ARG2DDAH1
SCHEMBL8871251 0.73 GSR (0.55) GSROTCARG1ARG2DDAH1
SCHEMBL56915 0.73 GSR (0.55) GSROTCARG1ARG2DDAH1
SCHEMBL5279090 0.73 GSR (0.55) GSROTCARG1ARG2DDAH1

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
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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