SCHEMBL4436284

SCHEMBL4436284

COc1ccccc1OCCN(C(Oc1cccc2[nH]c3ccccc3c12)C(C)O)C(Oc1cccc2[nH]c3ccccc3c12)C(C)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 9/20 0.55
ADRB3 P13945 4/20 0.55
DRD2 P14416 3/20 0.55
TLR4 O00206 3/20 0.55
MAPT P10636 2/20 0.55
DNM1 Q05193 2/20 0.55
KDM4E B2RXH2 2/20 0.55
ADRB1 P08588 2/20 0.55
SLC22A2 O15244 1/20 0.55
SLC22A1 O15245 1/20 0.55
MLNR O43193 1/20 0.55
NR1I2 O75469 1/20 0.55
KCNK2 O95069 1/20 0.55
ABCB11 O95342 1/20 0.55
APP P05067 1/20 0.55
ABCB1 P08183 1/20 0.55
HTR1A P08908 1/20 0.55
ADRA2A P08913 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
GAA P10253 1/20 0.55

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
SCHEMBL5375729 0.86 ADRB2 (0.50) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL789339 0.79 ADRB2 (0.63) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL4555826 0.77 ADRB2 (0.68) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL8277013 0.77 ADRB2 (0.68) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL13204418 0.77 ADRB2 (0.65) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL8199187 0.76 ADRB2 (0.67) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL7997039 0.76 ADRB2 (0.66) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL14582544 0.75 ADRB2 (0.63) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL15874588 0.75 ADRB2 (0.72) ADRB2ADRB3DRD2TLR4MAPT
SCHEMBL10123780 0.75 ADRB2 (0.65) ADRB2ADRB3DRD2TLR4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2114881-A1 PROCESS FOR THE PURIFICATION OF CARVEDILOL OR ITS SALTS THEREOF Teva Pharmaceutical Industries Ltd. (IL) 2009-11-11 EP claimed
WO-2008105794-A1 PROCESS FOR THE PURIFICATION OF CARVEDILOL OR ITS SALTS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2008-09-04 WO claimed
EP-2114881-A1 PROCESS FOR THE PURIFICATION OF CARVEDILOL OR ITS SALTS THEREOF Teva Pharmaceutical Industries Ltd. (IL) 2009-11-11 EP disclosed
EP-2114881-A1 PROCESS FOR THE PURIFICATION OF CARVEDILOL OR ITS SALTS THEREOF Teva Pharmaceutical Industries Ltd. (IL) 2009-11-11 EP disclosed
WO-2008105794-A1 PROCESS FOR THE PURIFICATION OF CARVEDILOL OR ITS SALTS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2008-09-04 WO disclosed
WO-2008105794-A1 PROCESS FOR THE PURIFICATION OF CARVEDILOL OR ITS SALTS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2008-09-04 WO disclosed