SCHEMBL7322372

SCHEMBL7322372

COc1ccc(CC(CC(=O)N2CCOCC2)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 3/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 2/20 0.50
GAA P10253 2/20 0.48
CYP2D6 P10635 1/20 0.48
CTSL P07711 1/20 0.46
MAPT P10636 2/20 0.45
ALDH1A1 P00352 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
MITF O75030 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
CACNA2D1 P54289 2/20 0.44
CACNA1B Q00975 2/20 0.44
CACNB1 Q02641 2/20 0.44
CACNA1C Q13936 2/20 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
SCHEMBL7322379 1.00 FKBP1A (0.54) FKBP1AMEN1KMT2ANPSR1HPGD
Hydrochloric Acid SCHEMBL7278911 0.88 MAPT (0.54) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL7269161 0.86 FKBP1A (0.62) FKBP1AKMT2AHPGDSMN1; SMN2POLB
SCHEMBL9832234 0.86 FKBP1A (0.62) FKBP1AKMT2AHPGDSMN1; SMN2POLB
SCHEMBL7269160 0.86 FKBP1A (0.62) FKBP1AKMT2AHPGDSMN1; SMN2POLB
SCHEMBL7269018 0.81 MEN1 (0.56) FKBP1AMEN1KMT2ANPSR1HPGD
SCHEMBL7269464 0.78 FKBP1A (0.58) FKBP1AMEN1KMT2ANPSR1HPGD
SCHEMBL7269457 0.78 FKBP1A (0.58) FKBP1AMEN1KMT2ANPSR1HPGD
SCHEMBL7291450 0.78 FKBP1A (0.58) FKBP1AMEN1KMT2ANPSR1HPGD
SCHEMBL19390153 0.76 MEN1 (0.61) FKBP1AMEN1KMT2ANPSR1HPGD

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-5378689-A Hypotensive agents; administrable by mouth SANKYO COMPANY, LIMITED (JP) 1995-01-03 US disclosed
US-5364844-A Hypotensive agents SANKYO COMPANY, LIMITED (JP) 1994-11-15 US disclosed
EP-0326364-B1 Renin inhibitory oligopeptides, their preparation and use SANKYO CO (JP) 1994-06-22 EP disclosed
EP-0326364-A2 Renin inhibitory oligopeptides, their preparation and use Sankyo Company Limited (JP) 1989-08-02 EP disclosed