SCHEMBL10955767

SCHEMBL10955767

CCOP(=O)(CC(=O)O)C(CCc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KLK1 P06870 2/20 0.51
▸ F2 P00734 2/20 0.51
▸ PLAU P00749 2/20 0.51
▸ PLAT P00750 2/20 0.51
▸ KLK8 O60259 1/20 0.51
▸ F10 P00742 1/20 0.51
▸ PLG P00747 1/20 0.51
▸ KLK2 P20151 1/20 0.51
▸ KLK4 Q9Y5K2 1/20 0.51
▸ CTSL P07711 5/20 0.47
▸ PRTN3 P24158 2/20 0.46
▸ KYNU Q16719 1/20 0.46
▸ ELANE P08246 2/20 0.45
▸ MME P08473 3/20 0.44
▸ ECE1 P42892 3/20 0.44
▸ ACE2 Q9BYF1 1/20 0.44
▸ MMP8 P22894 1/20 0.44
▸ MMP14 P50281 1/20 0.44
▸ CTSB P07858 2/20 0.43

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
SCHEMBL10957296 0.92 F2 (0.59) KLK1F2PLAUPLATKLK8
SCHEMBL10959861 0.91 F2 (0.51) KLK1F2PLAUPLATKLK8
SCHEMBL10960586 0.84 MME (0.52) KLK1F2PLAUPLATKLK8
SCHEMBL10955479 0.82 F2 (0.55) KLK1F2PLAUPLATKLK8
SCHEMBL11163829 0.81 ACE (0.59) ACE2
SCHEMBL10957871 0.80 F2 (0.57) KLK1F2PLAUPLATKLK8
SCHEMBL11173890 0.80 KLK1 (0.40) KLK1F2PLAUPLATKLK8
SCHEMBL10958284 0.80 KLK1 (0.42) KLK1F2PLAUPLATKLK8
SCHEMBL10955973 0.78 KYNU (0.56) KLK1F2PLAUPLATKLK8
SCHEMBL10957299 0.76 F2 (0.59) KLK1F2PLAUPLATKLK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0063896-B1 AMINO AND SUBSTITUTED AMINO PHOSPHINYL-ALKANOYL COMPOSITIONS E.R. Squibb & Sons, Inc. (US) 1985-08-14 — — EP disclosed
US-4416831-A ANGIOTENSIN INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1983-11-22 — — US disclosed
US-4374131-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1983-02-15 — — US disclosed
EP-0063896-A1 Amino and substituted amino phosphinyl-alkanoyl compositions E.R. Squibb & Sons, Inc. (US) 1982-11-03 — — EP disclosed
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