SCHEMBL7947397

SCHEMBL7947397

CC(C)(C)[Si](C)(C)OCCC1(Cc2ccccc2)CCCN(Cc2ccccc2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HCRTR2 O43614 9/20 0.38
HCRTR1 O43613 7/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL7000377 0.94 MEN1 (0.41) MEN1KMT2AHCRTR2HCRTR1L3MBTL1
SCHEMBL6997660 0.83 MAPK1 (0.39) MEN1KMT2AHCRTR1PDE4APDE4B
SCHEMBL7985088 0.78 MAPK1 (0.38) MEN1KMT2AHCRTR1PDE4APDE4B
SCHEMBL7954875 0.77 KMT2A (0.59) MEN1KMT2AHCRTR2HCRTR1L3MBTL1
SCHEMBL6733910 0.77 KMT2A (0.62) MEN1KMT2AHCRTR2HCRTR1L3MBTL1
SCHEMBL6997070 0.77 KMT2A (0.37) MEN1KMT2AHCRTR2HCRTR1ALDH1A1
SCHEMBL7954267 0.76 KMT2A (0.54) MEN1KMT2AHCRTR2HCRTR1L3MBTL1
SCHEMBL7971732 0.74 HRH1 (0.38) MEN1KMT2AHCRTR1KDM4EGAA
SCHEMBL7002664 0.74 HRH1 (0.40) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7961305 0.73 KDM4E (0.39) MEN1KMT2APDE4APDE4BPDE4C

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-6329392-B1 ANTIALLERGENS AVENTIS PHARMACEUTICALS, INC. 2001-12-11 US disclosed
EP-0777666-B1 SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMA INC (US) 1999-03-03 EP disclosed
EP-0777666-A1 NOVEL SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMACEUTICALS INC. (US) 1997-06-11 EP disclosed
WO-1996006094-A1 NOVEL SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMACEUTICALS INC. (US) 1996-02-29 WO disclosed