SCHEMBL7320323

SCHEMBL7320323

COC(=O)C1CCN(C(=O)[C@H](Cc2ccccc2)OC(C)C(N)=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
REN P00797 5/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
APOBEC3A P31941 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
F10 P00742 2/20 0.44
PLAU P00749 2/20 0.44
FPR2 P25090 1/20 0.44
PLG P00747 1/20 0.44

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
SCHEMBL7320331 1.00 ALDH1A1 (0.47) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL7324817 0.84 REN (0.52) HPGDHSD17B10RENGAATSHR
SCHEMBL9442930 0.84 REN (0.52) HPGDHSD17B10RENGAATSHR
SCHEMBL9442934 0.83 REN (0.59) REN
SCHEMBL7361787 0.83 REN (0.59) REN
SCHEMBL7316230 0.83 REN (0.54) HPGDHSD17B10RENGAATSHR
SCHEMBL7316226 0.83 REN (0.54) HPGDHSD17B10RENGAATSHR
SCHEMBL7316243 0.81 REN (0.54) ALDH1A1HPGDNPSR1HSD17B10REN
SCHEMBL7316236 0.81 REN (0.54) ALDH1A1HPGDNPSR1HSD17B10REN
SCHEMBL9442953 0.79 ALDH1A1 (0.55) ALDH1A1MAPTHPGDNPSR1HSD17B10

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