SCHEMBL8322299

SCHEMBL8322299

CC1CCC2C(C)(C)C(O)CCC2(C)C12Cc1c(O)cc3c(c1O2)CN(C(Cc1ccccc1)C(=O)O)C3=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ST6GAL1 P15907 3/20 0.60
ST3GAL1 Q11201 2/20 0.60
ST3GAL3 Q11203 2/20 0.60
FUT6 P51993 1/20 0.51
FUT5 Q11128 1/20 0.51
MAPT P10636 2/20 0.39
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD11B1 P28845 1/20 0.38
HSD17B2 P37059 1/20 0.38
HSD11B2 P80365 1/20 0.38
PTPN1 P18031 6/20 0.38
PTPN6 P29350 2/20 0.38
PTPN2 P17706 2/20 0.33
SDCBP O00560 2/20 0.33
SDC2 P34741 2/20 0.33
ITGB3 P05106 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGAV P06756 1/20 0.33
ITGA2B P08514 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
SCHEMBL16406507 0.69 ALOX15 (0.39) MAPTALOX15SMN1; SMN2PTPN1LMNA
SCHEMBL10081981 0.65 NR1H4 (0.35) MAPTALOX15SMN1; SMN2PTPN1SDCBP
SCHEMBL2624832 0.62 ALOX5 (0.33) PTPN1
SCHEMBL825642 0.59 MAPT (1.00) MAPTALOX15SMN1; SMN2SDCBPSDC2
SCHEMBL4203635 0.59 MAPT (1.00) MAPTALOX15SMN1; SMN2SDCBPSDC2
SCHEMBL20014176 0.58 MAPT (0.85) MAPTALOX15SMN1; SMN2SDCBPSDC2
SCHEMBL24064895 0.57 MAPT (0.74) MAPTALOX15SMN1; SMN2SDCBPSDC2
SCHEMBL24064924 0.56 MAPT (0.64) MAPTALOX15SMN1; SMN2SDCBPSDC2
SCHEMBL12643502 0.55 MAPT (0.74) MAPTALOX15SMN1; SMN2SDCBPSDC2
SCHEMBL2181074 0.55 MAPT (0.74) MAPTALOX15SMN1; SMN2SDCBPSDC2

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
EP-1572697-B1 SPIROBENZOFURANLACTAM DERIVATIVES, METHODS FOR THEIR PREPARATION, AND USE THEREOF SANOFI AVENTIS DEUTSCHLAND (DE) 2007-02-21 EP disclosed
US-7160917-B2 Spirobenzofuran lactams and their derivatives, processes for their preparation and use thereof SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-01-09 US disclosed
US-7160917-B2 Spirobenzofuran lactams and their derivatives, processes for their preparation and use thereof SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-01-09 US disclosed
WO-2004055021-A1 NOVEL SPIROBENZOFURANLACTAMS AND THE DERIVATIVES THEREOF, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-07-01 WO disclosed