SCHEMBL9304415

SCHEMBL9304415

CC(C)(C)[Si](OCc1cc2cc(OCc3ccccc3)ccc2c(-c2ccccc2)c1CO)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.44
ALOX5 P09917 6/20 0.43
PDE4A P27815 3/20 0.39
PDE4B Q07343 3/20 0.39
PDE4C Q08493 3/20 0.39
PDE4D Q08499 3/20 0.39
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
PDE5A O76074 1/20 0.39
PDE1A P54750 1/20 0.39
PDE1B Q01064 1/20 0.39
PDE1C Q14123 1/20 0.39
EGLN2 Q96KS0 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MAOB P27338 2/20 0.36
BCHE P06276 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
SCHEMBL9303283 0.85 ALOX5 (0.42) P2RY14ALOX5EGLN2EGLN1MAPT
SCHEMBL9303851 0.84 ALOX5 (0.45) P2RY14ALOX5EGLN2EGLN1NPC1
SCHEMBL9301951 0.82 P2RY14 (0.55) P2RY14ALOX5PDE4APDE4BPDE4C
SCHEMBL9303174 0.81 P2RY14 (0.41) P2RY14ALOX5EGLN2EGLN1MAOB
SCHEMBL9302893 0.75 P2RY14 (0.42) P2RY14ALOX5PDE4APDE4BPDE4C
SCHEMBL9301998 0.73 P2RY14 (0.61) P2RY14ALOX5MAOBKDM4EHSP90AA1
SCHEMBL9304408 0.72 P2RY14 (0.42) P2RY14ALOX5MAOBMAOAACHE
SCHEMBL9304278 0.72 P2RY14 (0.51) P2RY14ALOX5PDE4APDE4BPDE4C
SCHEMBL5106543 0.72 CYP4F2 (0.42) ALOX5RAB9AMAPTMAOBKDR
SCHEMBL9302951 0.72 P2RY14 (0.56) P2RY14ALOX5MAOBBCHEMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5281720-A Antiasthmatics, antiallergens, antiinflammatory agents and cytoprotective agents MERCK FROSST CANADA, INC. 1994-01-25 US disclosed
US-5227399-A Pyranylphenyl naphthalene lactones as inhibitors of leukotriene biosynthesis MERCK FROSST CANADA, INC. (CA) 1993-07-13 US disclosed
EP-0501579-A1 Naphthalene lactones as inhibitors of leukotriene biosynthesis MERCK FROSST CANADA INC. (CA) 1992-09-02 EP disclosed
EP-0501578-A1 Pyranylphenyl hydroxyalkylnaphthoic acids as inhibitors of leukotriene biosynthesis MERCK FROSST CANADA INC. (CA) 1992-09-02 EP disclosed