SCHEMBL8216358

SCHEMBL8216358

CC(S)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 11/20 0.51
MME P08473 10/20 0.51
CPA1 P15085 8/20 0.51
ACE2 Q9BYF1 8/20 0.51
ECE1 P42892 3/20 0.39

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
SCHEMBL8896490 0.89 ACE (0.41) ACEMMECPA1ACE2ECE1
SCHEMBL29071842 0.88 ACE (0.38) ACEMMECPA1ACE2ECE1
SCHEMBL3810013 0.86 CTRB1 (0.37) ACEMMECPA1ACE2
SCHEMBL749821 0.86 CTRB1 (0.37) ACEMMECPA1ACE2
SCHEMBL9665720 0.86 CTRB1 (0.37) ACEMMECPA1ACE2
SCHEMBL749822 0.86 CTRB1 (0.37) ACEMMECPA1ACE2
SCHEMBL17293240 0.86 CTRB1 (0.37) ACEMMECPA1ACE2
SCHEMBL3916119 0.86 CTRB1 (0.37) ACEMMECPA1ACE2
SCHEMBL29511173 0.86 CTRB1 (0.37) ACEMMECPA1ACE2
SCHEMBL3916112 0.86 CTRB1 (0.37) ACEMMECPA1ACE2

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-4140786-A ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1979-02-20 US claimed
US-6013798-A WATER-BASED COMPOSITION FOR DECORATING SUBSTRATE, I.E., CERAMIC OR GLASS WITH BRIGHT GOLD FILM UPON FIRING COMPRISING A NON-RADIOACTIVE GOLD THIOLATE JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2000-01-11 US disclosed
US-5744245-A POLYMERIC RESIN IN SOLUTION, WATER, COSOLVENT, AND THIOLATE OF PRECIOUS METAL JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 1998-04-28 US disclosed
EP-0514073-B1 Precious metal composition JOHNSON MATTHEY PLC (GB) 1995-07-05 EP disclosed
US-5401535-A Precious metal composition JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 1995-03-28 US disclosed
US-5281635-A Polym,er resin and water-solvent solution of thiolate of platinum, palladium, gold, or silver for forming film on firing JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 1994-01-25 US disclosed
EP-0514073-A2 Precious metal composition JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 1992-11-19 EP disclosed