SCHEMBL7353235

SCHEMBL7353235

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

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 2/20 0.47
▸ LTA4H P09960 3/20 0.46
▸ MME P08473 3/20 0.46
▸ CTSS P25774 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ ACE P12821 2/20 0.43
▸ ANPEP P15144 1/20 0.43
▸ ECE1 P42892 1/20 0.43
▸ ERAP2 Q6P179 1/20 0.42
▸ ERAP1 Q9NZ08 1/20 0.42
▸ LNPEP Q9UIQ6 1/20 0.42
▸ MMP8 P22894 1/20 0.41
▸ MMP14 P50281 1/20 0.41

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
SCHEMBL7329490 0.88 REN (0.54) RENMMEERAP2ERAP1LNPEP
SCHEMBL7328611 0.85 REN (0.53) RENMMEERAP2ERAP1LNPEP
SCHEMBL7338166 0.83 LTA4H (0.49) RENLTA4HMMEANPEP
SCHEMBL7330813 0.81 HSD17B10 (0.50) CTSSHSD17B10
SCHEMBL7338169 0.81 HSD17B10 (0.50) CTSSHSD17B10
SCHEMBL7333546 0.80 LTA4H (0.46) RENLTA4HMMEANPEP
SCHEMBL7332863 0.80 HSD17B10 (0.46) RENCTSSHSD17B10
SCHEMBL7336427 0.77 FCER2 (0.49) RENMMEERAP2ERAP1LNPEP
SCHEMBL7330912 0.77 REN (0.54) RENMMECTSSERAP2ERAP1
SCHEMBL7336719 0.75 FCER2 (0.47) RENMMEERAP2ERAP1LNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5258362-A Enzyme inhibitors, amides with oxetane ring ABBOTT LABORATORIES (US) 1993-11-02 — — US disclosed
WO-1992022313-A1 RENIN INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1992-12-23 — — WO disclosed
Send feedback