SCHEMBL7470650

SCHEMBL7470650

CCOC(=O)c1ccc(N2CCC(NCC(O)COc3ccc(OCc4ccccc4)c(NC(C)=O)c3)CC2)nc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ABCB11 O95342 1/20 0.45
P2RY12 Q9H244 1/20 0.44
ADRB3 P13945 8/20 0.42
ADRB2 P07550 7/20 0.42
ADRB1 P08588 7/20 0.42
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MITF O75030 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DGAT1 O75907 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
RAD52 P43351 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL7472518 0.91 LMNA (0.45) LMNAP2RY12ADRB3ADRB2ADRB1
SCHEMBL7560376 0.89 LMNA (0.56) LMNAP2RY12ADRB3ADRB2ADRB1
SCHEMBL7461831 0.88 LMNA (0.46) LMNAP2RY12ADRB3ADRB2ADRB1
SCHEMBL7467963 0.87 LMNA (0.44) LMNAABCB11P2RY12ADRB3ADRB2
SCHEMBL7467859 0.87 LMNA (0.45) LMNAP2RY12ADRB3ADRB2ADRB1
SCHEMBL7470654 0.85 P2RY12 (0.47) LMNAABCB11P2RY12ADRB3ADRB2
SCHEMBL7473044 0.82 ADRB3 (0.52) LMNAP2RY12ADRB3ADRB2ADRB1
SCHEMBL7469004 0.82 ADRB3 (0.52) LMNAP2RY12ADRB3ADRB2ADRB1
SCHEMBL5203047 0.81 ADRB3 (0.48) LMNAADRB3ADRB2ADRB1MAPT
SCHEMBL6140089 0.81 P2RY12 (0.41) LMNAP2RY12MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1087961-B1 PHENOXYLPROPANOLAMINES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME SANOFI SYNTHELABO (FR) 2002-08-14 EP disclosed