SCHEMBL8847784

SCHEMBL8847784

CCCCCOC(=O)OCOC=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.46
HCAR2 Q8TDS4 2/20 0.44
EPHX1 P07099 1/20 0.43
ATM Q13315 1/20 0.42
TSHR P16473 5/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPK1 P28482 1/20 0.40
RAD52 P43351 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FAAH O00519 1/20 0.39
LMNA P02545 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ACHE P22303 3/20 0.38

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
SCHEMBL20751567 0.98 NAAA (0.48) NAAAHCAR2EPHX1ATMTSHR
SCHEMBL8847799 0.98 NAAA (0.48) NAAAHCAR2EPHX1ATMTSHR
SCHEMBL8847641 0.94 ATM (0.48) NAAAHCAR2EPHX1ATMTSHR
SCHEMBL8848028 0.86 HCAR2 (0.39) HCAR2ATMTSHRALDH1A1HPGD
SCHEMBL37366 0.82 NAAA (0.62) NAAAHCAR2EPHX1ATMTSHR
SCHEMBL1834574 0.80 NAAA (0.67) NAAAHCAR2EPHX1TSHRALDH1A1
SCHEMBL1839030 0.80 NAAA (0.67) NAAAHCAR2EPHX1TSHRALDH1A1
SCHEMBL1837444 0.80 NAAA (0.67) NAAAHCAR2EPHX1TSHRALDH1A1
SCHEMBL1839498 0.80 NAAA (0.67) NAAAHCAR2EPHX1TSHRALDH1A1
SCHEMBL1838958 0.80 NAAA (0.67) NAAAHCAR2EPHX1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
US-5482948-A Pyridyl derivatives and pharmaceutical compositions comprising these compounds DR. KARL THOMAE GMBH (DE) 1996-01-09 US disclosed
US-5459147-A Angeotensin-antagonistic effects; hypotensive, antiischemic, and antidiabetic agents, treating glaucoma DR. KARL THOMAE GMBH (DE) 1995-10-17 US disclosed