SCHEMBL7296171

SCHEMBL7296171

COC(=O)CN(C1CCCCC1)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.46
GAA P10253 1/20 0.46
EPHX2 P34913 4/20 0.43
TSHR P16473 2/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 1/20 0.36
SLC6A9 P48067 1/20 0.36

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
SCHEMBL18469983 0.98 NPSR1 (0.45) NPSR1GAAEPHX2TSHRMEN1
SCHEMBL2276331 0.86 SLC6A4 (0.39) NPSR1GAAEPHX2
SCHEMBL2276334 0.86 SLC6A4 (0.39) NPSR1GAAEPHX2
SCHEMBL6628285 0.84 L3MBTL1 (0.46) NPSR1EPHX2TSHRMEN1KMT2A
SCHEMBL24359375 0.81 GAA (0.44) NPSR1GAATSHRMEN1KMT2A
SCHEMBL8377528 0.81 KMT2A (0.47) NPSR1GAAEPHX2TSHRMEN1
SCHEMBL4159697 0.79 EPHX2 (0.40) NPSR1EPHX2TSHRALDH1A1LMNA
SCHEMBL18494973 0.79 EPHX1 (0.34) NPSR1GAAEPHX2TSHRALDH1A1
SCHEMBL18469929 0.78 SMN1; SMN2 (0.37) GAAMEN1KMT2AALDH1A1LMNA
Hydrochloric Acid SCHEMBL28933506 0.78 GNAI3 (0.33) NPSR1GAAEPHX2TSHRMEN1

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-5378690-A Treatment of angiotensin induced hypertension SANKYO COMPANY, LIMITED (JP) 1995-01-03 US disclosed
EP-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 EP disclosed