SCHEMBL7324817

SCHEMBL7324817

C[C@H](O[C@@H](Cc1ccccc1)C(=O)N1CCC1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 5/20 0.52
CHRM1 P11229 7/20 0.50
HSD17B10 Q99714 1/20 0.48
HPGD P15428 2/20 0.46
TSHR P16473 2/20 0.46
GAA P10253 1/20 0.46
ACE P12821 1/20 0.42
SRR Q9GZT4 1/20 0.42

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
SCHEMBL9442930 0.97 REN (0.52) RENCHRM1HSD17B10HPGDTSHR
SCHEMBL7316230 0.96 REN (0.54) RENCHRM1HSD17B10HPGDTSHR
SCHEMBL7316226 0.96 REN (0.54) RENCHRM1HSD17B10HPGDTSHR
SCHEMBL7316236 0.89 REN (0.54) RENCHRM1HSD17B10HPGDTSHR
SCHEMBL7316243 0.89 REN (0.54) RENCHRM1HSD17B10HPGDTSHR
SCHEMBL7320323 0.84 ALDH1A1 (0.47) RENHSD17B10HPGDTSHRGAA
SCHEMBL7320331 0.84 ALDH1A1 (0.47) RENHSD17B10HPGDTSHRGAA
SCHEMBL7361787 0.82 REN (0.59) REN
SCHEMBL9442934 0.82 REN (0.59) REN
SCHEMBL7316518 0.75 REN (0.56) REN

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-5268374-A Containing both amide and hydroxy groups ABBOTT LABORATORIES (US) 1993-12-07 US disclosed
EP-0437508-A1 NON-PEPTIDE RENIN INHIBITORS ABBOTT LABORATORIES (US) 1991-07-24 EP disclosed
EP-0364804-A1 Non-peptide renin inhibitors ABBOTT LABORATORIES (US) 1990-04-25 EP disclosed
WO-1990003971-A1 NON-PEPTIDE RENIN INHIBITORS ABBOTT LABORATORIES (US) 1990-04-19 WO disclosed