SCHEMBL9697205

SCHEMBL9697205

COC(=O)C(C)CP(=O)(O)C(C)N

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.35
LAP3 P28838 1/20 0.35
LTA4H P09960 1/20 0.35
MME P08473 1/20 0.35
ENPEP Q07075 1/20 0.34
MMP1 P03956 2/20 0.33
MMP2 P08253 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
CA9 Q16790 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP3 P08254 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
SCHEMBL2466027 0.79 MMP1 (0.38) MMP1MMP2CA12CA1CA2
SCHEMBL5456859 0.79 MMP1 (0.38) MMP1MMP2CA12CA1CA2
SCHEMBL9696243 0.78 ANPEP (0.46) ANPEPLAP3LTA4HENPEP
SCHEMBL2403902 0.78 GABRR1 (0.39) MMP1MMP2CA12CA1CA2
SCHEMBL15259072 0.76 MMP1 (0.35) MMP1MMP2CA12CA1CA2
SCHEMBL8565444 0.75 SMN1; SMN2 (0.38) MMP1MMP2CA12CA1CA2
SCHEMBL8558146 0.75 SMN1; SMN2 (0.38) MMP1MMP2CA12CA1CA2
SCHEMBL8565442 0.75 SMN1; SMN2 (0.38) MMP1MMP2CA12CA1CA2
SCHEMBL2352012 0.74 MMP1 (0.38) MMP1MMP2CA12CA1CA2
SCHEMBL5037065 0.74 LAP3 (0.57) ANPEPLAP3ENPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5143908-A Carboxylic acids containing amino and phosphinyl groups MERCK & CO., INC. (US) 1992-09-01 US claimed
US-5099063-A 3-(1-aminoalkylphosphinyl)-(2-substituted)propionic acids MERCK & CO., INC. (US) 1992-03-24 US claimed
EP-0266978-A2 Novel antibacterial agents and potentiators of carbapenem antibiotics MERCK & CO. INC. (US) 1988-05-11 EP claimed
US-5143908-A Carboxylic acids containing amino and phosphinyl groups MERCK & CO., INC. (US) 1992-09-01 US disclosed
US-5099063-A 3-(1-aminoalkylphosphinyl)-(2-substituted)propionic acids MERCK & CO., INC. (US) 1992-03-24 US disclosed
EP-0266978-A2 Novel antibacterial agents and potentiators of carbapenem antibiotics MERCK & CO. INC. (US) 1988-05-11 EP disclosed
US-4715994-A PHOSPHINIC ACID DERIVATIVES MERCK & CO., INC. (US) 1987-12-29 US disclosed