SCHEMBL8847641

SCHEMBL8847641

CCCCOC(=O)OCOC=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
ALDH1A1 P00352 1/20 0.47
TSHR P16473 5/20 0.46
HPGD P15428 1/20 0.46
HCAR2 Q8TDS4 3/20 0.43
NAAA Q02083 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
EPHX1 P07099 1/20 0.36
LMNA P02545 1/20 0.36
ESR1 P03372 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
NR1H2 P55055 1/20 0.36
RNASEL Q05823 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
SCHEMBL8847784 0.94 NAAA (0.46) ATMALDH1A1TSHRHPGDHCAR2
SCHEMBL20751567 0.93 NAAA (0.48) ATMALDH1A1TSHRHCAR2NAAA
SCHEMBL8847799 0.93 NAAA (0.48) ATMALDH1A1TSHRHCAR2NAAA
SCHEMBL8848028 0.88 HCAR2 (0.39) ATMALDH1A1TSHRHPGDHCAR2
SCHEMBL13465905 0.83 ALDH1A1 (0.58) ATMALDH1A1TSHRHPGDHCAR2
SCHEMBL37837 0.81 ALDH1A1 (0.67) ATMALDH1A1TSHRHPGDHCAR2
SCHEMBL1823494 0.79 ALDH1A1 (0.59) ALDH1A1HCAR2MAPTNPSR1LMNA
SCHEMBL4553342 0.79 ALDH1A1 (0.64) ATMALDH1A1TSHRHPGDHCAR2
SCHEMBL28758644 0.79 ALDH1A1 (0.64) ATMALDH1A1TSHRHPGDHCAR2
SCHEMBL14890682 0.79 ALDH1A1 (0.64) ATMALDH1A1TSHRHPGDHCAR2

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