SCHEMBL7540226

SCHEMBL7540226

CC(=O)c1ccc(N)cc1.NCC1CCC(C(=O)N[C@@H](Cc2cccc(Oc3ccccc3)c2)C(=O)O)CC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PLG P00747 6/20 0.61
▸ KLKB1 P03952 2/20 0.61
▸ PLAU P00749 1/20 0.61
▸ F11 P03951 9/20 0.51
▸ LMNA P02545 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ MME P08473 1/20 0.47
▸ ACE P12821 1/20 0.47
▸ CPA1 P15085 1/20 0.47
▸ ACE2 Q9BYF1 1/20 0.47
▸ PRSS1 P07477 5/20 0.47
▸ PRSS2 P07478 5/20 0.47
▸ PRSS3 P35030 5/20 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
SCHEMBL7540234 1.00 PLG (0.61) PLGKLKB1PLAUF11LMNA
Hydrochloric Acid SCHEMBL7275801 0.99 PLG (0.60) PLGKLKB1PLAUF11LMNA
Hydrochloric Acid SCHEMBL7545755 0.99 PLG (0.60) PLGKLKB1PLAUF11LMNA
SCHEMBL6450462 0.90 KLKB1 (0.74) PLGKLKB1PLAUF11LMNA
SCHEMBL5961152 0.90 KLKB1 (0.74) PLGKLKB1PLAUF11LMNA
SCHEMBL7440177 0.90 F11 (0.60) PLGKLKB1PLAUF11LMNA
SCHEMBL7440172 0.90 F11 (0.60) PLGKLKB1PLAUF11LMNA
SCHEMBL7548830 0.87 PLG (0.47) PLGKLKB1PLAUF11LMNA
SCHEMBL7443945 0.85 PLG (0.63) PLGKLKB1PLAUPRSS1PRSS2
SCHEMBL7443929 0.85 PLG (0.63) PLGKLKB1PLAUPRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4873253-A Phenylalanine derivative and proteinase inhibitor Okamoto, Shosuke (JP) 1989-10-10 — — US claimed
EP-0284632-A1 Phenylalanine derivative and proteinase inhibitor Okamoto, Shosuke (JP) 1988-10-05 — — EP claimed
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