SCHEMBL31516099

SCHEMBL31516099

NC(=O)CNC(=O)C(Cc1ccccc1)CP(=O)(O)CC(Cc1ccccc1)C(=O)NCC(N)=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 5/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ ACE P12821 2/20 0.54
▸ ECE1 P42892 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ NPEPPS P55786 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ANPEP P15144 1/20 0.47
▸ ERAP2 Q6P179 1/20 0.47

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
SCHEMBL4442570 0.82 MME (0.78) MMEALDH1A1ACEECE1HPGD
SCHEMBL31516101 0.81 ERAP2 (0.62) ERAP2
SCHEMBL31516107 0.80 MME (0.58) MMEANPEPERAP2
SCHEMBL31516070 0.78 ECE1 (0.69) MMEECE1ANPEP
SCHEMBL14963151 0.77 ALPI (0.58) MMEALDH1A1ACEHPGDMAPK1
SCHEMBL8789703 0.77 ALPI (0.58) MMEALDH1A1ACEHPGDMAPK1
SCHEMBL8788898 0.77 ALPI (0.58) MMEALDH1A1ACEHPGDMAPK1
SCHEMBL14963149 0.76 CYP3A4 (0.65) MMEALDH1A1ACEECE1HPGD
SCHEMBL18286819 0.76 MMP2 (0.50) MMEALDH1A1ACEECE1HPGD
SCHEMBL31516083 0.76 ERAP2 (0.64) MMEERAP2

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-119751501-A Symmetrical phosphinic acid compound, symmetrical phosphinic acid amino acid derivative, and preparation methods and application thereof 西交利物浦大学 2025-04-04 — — CN disclosed
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