SCHEMBL5140146

SCHEMBL5140146

CCCC[Si](C)(C)Oc1cc(F)ccc1C=O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FAAH O00519 1/20 0.34
ERN1 O75460 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL7187320 0.82 ALDH1A1 (0.47) ALDH1A1L3MBTL1ERN1KDM4E
SCHEMBL7111394 0.82 ALDH1A1 (0.56) ALDH1A1L3MBTL1ERN1KDM4E
SCHEMBL5087695 0.78 FAAH (0.42) FAAH
SCHEMBL13191450 0.78 ALDH1A1 (0.49) ALDH1A1L3MBTL1FAAH
SCHEMBL7907354 0.78 CYP1A2 (0.38) ALDH1A1L3MBTL1ERN1
SCHEMBL1421106 0.77 SLC6A4 (0.37) ALDH1A1FAAHKDM4E
SCHEMBL10385008 0.75 ALDH1A1 (0.46) ALDH1A1L3MBTL1
SCHEMBL14920180 0.74
SCHEMBL6902425 0.74 PTPN1 (0.38) ALDH1A1L3MBTL1ERN1KDM4E
SCHEMBL30933880 0.73 ALDH1A1 (0.50) ALDH1A1L3MBTL1ERN1

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
EP-1601348-A4 COMPOSITIONS AND METHODS WITH ENHANCED THERAPEUTIC ACTIVITY OXIGENE INC (US) 2008-12-10 EP disclosed
EP-1601348-A2 COMPOSITIONS AND METHODS WITH ENHANCED THERAPEUTIC ACTIVITY OXIGENE, INC. (US) 2005-12-07 EP disclosed
WO-2004078126-A2 COMPOSITIONS AND METHODS WITH ENHANCED THERAPEUTIC ACTIVITY OXIGENE, INC. (US) 2004-09-16 WO disclosed