SCHEMBL29269090

SCHEMBL29269090

CC(C)C[C@H](N)C(=O)OC(=O)OC(=O)[C@@H](N)CC(C)C.[NaH].[NaH]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.52
▸ SLC1A3 P43003 3/20 0.41
▸ SLC1A2 P43004 3/20 0.41
▸ ANPEP P15144 7/20 0.39
▸ RNPEP Q9H4A4 3/20 0.39
▸ DNPEP Q9ULA0 2/20 0.39
▸ LAP3 P28838 4/20 0.35
▸ ERAP1 Q9NZ08 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ SLC1A1 P43005 2/20 0.34
▸ LARS1 Q9P2J5 1/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ DPP8 Q6V1X1 1/20 0.33
▸ DPP9 Q86TI2 1/20 0.33
▸ DPP7 Q9UHL4 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ CACNA2D1 P54289 2/20 0.32
▸ CACNB3 P54284 1/20 0.32

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
SCHEMBL10534765 0.89 SLC7A5 (0.50) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL995721 0.89 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL9100153 0.89 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
Hydrochloric Acid SCHEMBL27860866 0.84 SOAT1 (0.50) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL8348645 0.83 SLC7A5 (0.44) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL11776772 0.83 SLC7A5 (0.44) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL541251 0.83 SLC7A5 (0.52) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL16670559 0.83 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL16062283 0.83 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL7676359 0.83 SLC7A5 (0.52) SLC7A5SLC1A3SLC1A2ANPEPRNPEP

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-115677762-B Benzenesulfonyl amino phosphonate derivative and preparation method and application thereof 遵义医科大学 2024-06-25 — — CN disclosed
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