SCHEMBL31300261

SCHEMBL31300261

CC(C)(C)c1cn(C(=O)C(N)CCC[C@H](N)C(=O)O)nn1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ARG1 P05089 3/20 0.37
▸ GSR P00390 1/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ KIF11 P52732 4/20 0.35
▸ DPP4 P27487 1/20 0.34
▸ NOS1 P29475 3/20 0.34
▸ GRIA1 P42261 2/20 0.34
▸ GRIA2 P42262 2/20 0.34
▸ GRIA3 P42263 2/20 0.34
▸ GRIA4 P48058 2/20 0.34
▸ NOS3 P29474 2/20 0.34
▸ NOS2 P35228 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ ARG2 P78540 2/20 0.33
▸ GRM2 Q14416 1/20 0.33
▸ GRM3 Q14832 1/20 0.33

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
SCHEMBL34467662 0.81 OTC (0.36) ARG1GSRNOS1NOS3NOS2
SCHEMBL31300250 0.76 KMT2A (0.45) KMT2APOLBTDP1NOS1MEN1
SCHEMBL31300278 0.75 ARG1 (0.36) ARG1GSRKMT2APOLBTDP1
SCHEMBL31300275 0.74 DPP4 (0.38) ARG1KMT2APOLBTDP1DPP4
SCHEMBL31300271 0.74 LTA4H (0.42) ARG1KMT2APOLBTDP1DPP4
SCHEMBL31300282 0.72 KMT2A (0.38) ARG1KMT2APOLBTDP1NOS1
SCHEMBL31300257 0.72 HDAC3 (0.43) ARG1KMT2APOLBTDP1KIF11
SCHEMBL10135848 0.66 GSR (0.71) ARG1GSRKMT2ANOS1GRIA1
SCHEMBL29291 0.66 GSR (0.71) ARG1GSRKMT2ANOS1GRIA1
SCHEMBL29289 0.66 GSR (0.71) ARG1GSRKMT2ANOS1GRIA1

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
CN-119213061-A Cross-linked protein, method for producing the same and use thereof 纽约州立大学研究基金会 2024-12-27 — — CN disclosed
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