SCHEMBL7709013

SCHEMBL7709013

CCCN(c1ccc(CC(=O)OC)c(C(F)(F)F)c1)N(C[C@H](O[Si](C)(C)C(C)(C)C)c1cccc(Cl)c1)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.33
NR1H3 Q13133 3/20 0.33
POLQ O75417 1/20 0.33
P2RX7 Q99572 1/20 0.30

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
SCHEMBL7714535 0.91
SCHEMBL7714673 0.91 S1PR3 (0.31)
SCHEMBL7714949 0.91
SCHEMBL7712723 0.86
SCHEMBL7714625 0.83 S1PR3 (0.30)
SCHEMBL7708989 0.82
SCHEMBL7714681 0.82 NR1H2 (0.34) NR1H2NR1H3POLQP2RX7
SCHEMBL7714678 0.82 NR1H2 (0.34) NR1H2NR1H3POLQP2RX7
SCHEMBL7708897 0.81 NR1H2 (0.31) NR1H2NR1H3
SCHEMBL8907748 0.81 POLB (0.36) NR1H2NR1H3

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
EP-0865421-B1 ARYLETHANOLAMINE DERIVATIVES AND THEIR USE AS AGONISTS OF ATYPICAL BETA-ADRENOCEPTORS GLAXO GROUP LTD (GB) 2002-03-27 EP disclosed
US-6048872-A DIETETICS; ANTIDIABETIC AGENTS; CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS GLAXO WELLCOME INC. (US) 2000-04-11 US disclosed