SCHEMBL7347690

SCHEMBL7347690

CCC(C)C(NC(=O)C(C)NC1(C(C)=O)CCCCC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 6/20 0.58
ELANE P08246 4/20 0.45
CTSD P07339 9/20 0.44
MME P08473 1/20 0.39
ACE P12821 1/20 0.39
CPA1 P15085 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
F2 P00734 1/20 0.38

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
SCHEMBL7358144 0.90 REN (0.54) RENELANECTSD
SCHEMBL9439729 0.89 REN (0.61) RENELANECTSDF2
Hydrochloric Acid SCHEMBL7354069 0.88 REN (0.61) RENELANECTSDF2
SCHEMBL7346470 0.86 REN (0.43) RENCTSD
SCHEMBL7347632 0.83 REN (0.67) RENELANECTSDMMEACE
SCHEMBL7347699 0.80 REN (0.66) RENELANECTSDMMEACE
SCHEMBL7351550 0.78 REN (0.57) RENELANECTSD
SCHEMBL7351566 0.78 REN (0.57) RENELANECTSD
SCHEMBL7349102 0.77 REN (0.41) RENCTSD
SCHEMBL7377290 0.77 REN (0.56) RENELANECTSD

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
US-5338726-A Hypotensive agents, antiulcer agents ABBOTT LABORATORIES (US) 1994-08-16 US claimed
WO-1992013545-A1 ENDOTHELIN CONVERTING ENZYME INHIBITORS ABBOTT LABORATORIES (US) 1992-08-20 WO claimed
US-5338726-A Hypotensive agents, antiulcer agents ABBOTT LABORATORIES (US) 1994-08-16 US disclosed
WO-1992013545-A1 ENDOTHELIN CONVERTING ENZYME INHIBITORS ABBOTT LABORATORIES (US) 1992-08-20 WO disclosed