SCHEMBL7329490

SCHEMBL7329490

CC(C)C[C@H](NC(=O)C(Cc1ccccc1)CS(=O)(=O)N1CCN(C)CC1)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.54
FCER2 P06734 2/20 0.50
MMP1 P03956 1/20 0.50
MME P08473 1/20 0.49
ERAP2 Q6P179 5/20 0.48
ERAP1 Q9NZ08 5/20 0.48
LNPEP Q9UIQ6 5/20 0.48

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
SCHEMBL7328611 0.96 REN (0.53) RENFCER2MMP1MMEERAP2
SCHEMBL7330912 0.89 REN (0.54) RENFCER2MMP1MMEERAP2
SCHEMBL7336427 0.89 FCER2 (0.49) RENFCER2MMP1MMEERAP2
SCHEMBL7353235 0.88 REN (0.47) RENMMEERAP2ERAP1LNPEP
SCHEMBL7336719 0.87 FCER2 (0.47) RENFCER2MMP1MMEERAP2
SCHEMBL7338166 0.86 LTA4H (0.49) RENMME
SCHEMBL7334299 0.83 MME (0.47) RENFCER2MMP1MMEERAP2
SCHEMBL7336138 0.83 REN (0.51) RENFCER2MMP1
SCHEMBL7333546 0.83 LTA4H (0.46) RENMME
SCHEMBL7379849 0.82 REN (0.63) RENFCER2MMP1MMEERAP2

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-5332742-A Ocular hypotensive ABBOTT LABORATORIES (US) 1994-07-26 US disclosed
US-5310740-A Congestive heart failure, hypotensive agents, antiglaucoma agents; side effect reduction ABBOTT LABORATORIES (US) 1994-05-10 US disclosed
US-5284849-A Treating hypertension and congestive heart failure ABBOTT LABORATORIES (US) 1994-02-08 US disclosed
EP-0456185-A2 Renin inhibitors ABBOTT LABORATORIES (US) 1991-11-13 EP disclosed