SCHEMBL8348356

SCHEMBL8348356

COC(=O)c1cccc(O[C@@H]2CCOc3ccc(Oc4ccc5ccccc5n4)cc3[C@@H]2O)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
PDE4B Q07343 3/20 0.41
PPARG P37231 3/20 0.38
CNR2 P34972 1/20 0.37
PDE10A Q9Y233 1/20 0.35
LTB4R Q15722 2/20 0.35
ALOX5AP P20292 2/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
TNK2 Q07912 1/20 0.33
ALOX5 P09917 1/20 0.33

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
SCHEMBL8348350 1.00 CYSLTR1 (0.44) CYSLTR1L3MBTL1PDE4BPPARGCNR2
SCHEMBL8348346 1.00 CYSLTR1 (0.44) CYSLTR1L3MBTL1PDE4BPPARGCNR2
SCHEMBL8353789 0.91 GPBAR1 (0.42) CYSLTR1PDE4BPPARGLTB4RALOX5
SCHEMBL8353780 0.91 GPBAR1 (0.42) CYSLTR1PDE4BPPARGLTB4RALOX5
SCHEMBL8353796 0.91 GPBAR1 (0.42) CYSLTR1PDE4BPPARGLTB4RALOX5
SCHEMBL8464670 0.86 CYSLTR1 (0.64) CYSLTR1LTB4RALOX5AP
SCHEMBL8348539 0.86 LTB4R (0.41) PDE4BLTB4RALOX5
SCHEMBL8352997 0.86 LTB4R (0.41) PDE4BLTB4RALOX5
SCHEMBL8353000 0.86 LTB4R (0.41) PDE4BLTB4RALOX5
SCHEMBL8348530 0.86 LTB4R (0.41) PDE4BLTB4RALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952326-A Tetralin and chroman derivatives useful in the treatment of asthma, arthritis and related diseases PFIZER INC. (US) 1999-09-14 US disclosed
US-5698550-A Tetralin and chroman derivatives useful in the treatment of asthma, arthritis and related diseases PFIZER INC. (US) 1997-12-16 US disclosed
EP-0441515-B1 Tetralin and chroman derivatives in the treatment of asthma, arthritis and related diseases PFIZER (US) 1995-10-04 EP disclosed