SCHEMBL1041202

SCHEMBL1041202

CCOC(=O)C1(I)CC1CO

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
ALDH1A1 P00352 2/20 0.33
OPRM1 P35372 2/20 0.33
LMNA P02545 3/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.32
ALOX15 P16050 2/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPK1 P28482 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL30706721 0.77 POLB (0.36) POLBALDH1A1OPRM1LMNAATM
SCHEMBL12057961 0.77 POLB (0.36) POLBALDH1A1OPRM1LMNAATM
SCHEMBL15337099 0.76 F10 (0.37) POLBALDH1A1OPRM1LMNAATM
SCHEMBL14979290 0.74 POLB (0.34) POLBALDH1A1OPRM1LMNAATM
SCHEMBL7513123 0.74 POLB (0.34) POLBALDH1A1OPRM1LMNAATM
SCHEMBL13537384 0.74 POLB (0.34) POLBALDH1A1OPRM1LMNAATM
SCHEMBL12037372 0.73 LMNA (0.35) POLBALDH1A1OPRM1LMNAATM
SCHEMBL8353589 0.73 OPRM1 (0.36) POLBALDH1A1OPRM1LMNAATM
SCHEMBL7807558 0.71 ALOX15 (0.38) POLBALDH1A1OPRM1LMNAATM
SCHEMBL7807553 0.71 ALOX15 (0.38) POLBALDH1A1OPRM1LMNAATM

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-2274279-A1 NITRIC OXIDE DONATING PROSTAMIDES Nicox S.A. (FR) 2011-01-19 EP disclosed
WO-2009136281-A1 NITRIC OXIDE DONATING PROSTAMIDES NICOX S.A. (FR) 2009-11-12 WO disclosed