SCHEMBL8957110

SCHEMBL8957110

CCCCC(C(=O)NC(Cc1c[nH]cn1)C(=O)O)C(C)Cc1ccc(C(=O)O)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 7/20 0.35
▸ ACE P12821 9/20 0.33
▸ CPA1 P15085 6/20 0.33
▸ ACE2 Q9BYF1 6/20 0.33
▸ ERAP2 Q6P179 2/20 0.33
▸ ERAP1 Q9NZ08 2/20 0.33
▸ LNPEP Q9UIQ6 2/20 0.33
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ GRN P28799 1/20 0.32
▸ SORT1 Q99523 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ EPHX2 P34913 1/20 0.31
▸ NR1H4 Q96RI1 1/20 0.31

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
SCHEMBL7049829 0.88 MME (0.41) MMEACECPA1ACE2
SCHEMBL8957132 0.87 HCAR3 (0.38) MME
SCHEMBL8957141 0.86 ACE (0.42) MMEACECPA1ACE2
SCHEMBL8957142 0.86 MME (0.36) MMEACECPA1ACE2
SCHEMBL8971512 0.83 ACE (0.37) MMEACECPA1ACE2
SCHEMBL8957107 0.83 ACE (0.39) MMEACECPA1ACE2
SCHEMBL8971441 0.81 ACE (0.40) MMEACECPA1ACE2
SCHEMBL8957278 0.76 ACE (0.40) MMEACECPA1ACE2
SCHEMBL8957204 0.74 ACE (0.42) MMEACECPA1ACE2
SCHEMBL7056866 0.72 ACE (0.37) MMEACECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5565480-A ANGIOTENSIN II RECEPTOR ANTAGONIST; USEFUL IN REGULATING HYPERTENSION, TREATMENT OF CONGESTIVE HEART FAILURE, RENAL FAILURE AND GLUCOMA SMITHKLINE BEECHAM CORPORATION (US) 1996-10-15 — — US disclosed
EP-0536262-A4 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORP (US) 1996-08-14 — — EP disclosed
US-5444081-A Treatment of hypertension, congestive heart failure, renal failure, glaucoma SMITHKLINE BEECHAM CORP (US) 1995-08-22 — — US disclosed
EP-0536262-A1 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORPORATION (US) 1993-04-14 — — EP disclosed
WO-1992000068-A1 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORPORATION (US) 1992-01-09 — — WO disclosed
Send feedback