SCHEMBL6410787

SCHEMBL6410787

CC(=O)OC[C@H]1OC(Oc2ccc(I)cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.58
ALDH1A1 P00352 1/20 0.58
POLB P06746 1/20 0.58
HSD17B10 Q99714 2/20 0.55
CYP2D6 P10635 1/20 0.55
THRB P10828 1/20 0.55
TSHR P16473 1/20 0.54
MEN1 O00255 3/20 0.54
CYP3A4 P08684 3/20 0.54
KMT2A Q03164 3/20 0.54
TP53 P04637 1/20 0.54
CYP2C9 P11712 1/20 0.54
USP2 O75604 1/20 0.53
MAPK1 P28482 1/20 0.53
P4HB P07237 1/20 0.52
PDIA4 P13667 1/20 0.52
PDIA3 P30101 1/20 0.52
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
CASP1 P29466 1/20 0.50

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
SCHEMBL13311114 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL13311074 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL15006516 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL15040782 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL2039373 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL14852936 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL16847549 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL17366230 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL13347802 1.00 LMNA (0.58) LMNAALDH1A1POLBHSD17B10CYP2D6
SCHEMBL23457442 0.89 LMNA (0.62) LMNAALDH1A1POLBHSD17B10CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562951-A2 PORPHYRIN DERIVATIVES Photobiotics Ltd. (GB) 2005-08-17 EP disclosed
WO-2004046151-A2 PORPHYRIN DERIVATIVES PHOTOBIOTICS LIMITED (GB) 2004-06-03 WO disclosed