SCHEMBL11051208

SCHEMBL11051208

CC(C)OC(=O)COCC(I)=C(I)I

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 3/20 0.35
TDP1 Q9NUW8 1/20 0.32
CYP2D6 P10635 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
STAT3 P40763 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL11115364 0.85 LMNA (0.46) LMNAMAPTTSHRTDP1CYP2D6
SCHEMBL26315999 0.81 TSHR (0.44) LMNAMAPTTSHRTDP1CYP2D6
SCHEMBL11058491 0.77 TSHR (0.40) LMNATSHRKDM4EMEN1KMT2A
SCHEMBL645857 0.75 TDP1 (0.41) LMNAMAPTTSHRTDP1CYP2D6
SCHEMBL7651937 0.74 TDP1 (0.43) LMNAMAPTTSHRTDP1CYP2D6
SCHEMBL5085700 0.74 LMNA (0.42) LMNAMAPTTSHRTDP1CYP2D6
SCHEMBL5607572 0.74 LMNA (0.47) LMNAMAPTTSHRTDP1CYP2D6
SCHEMBL24033557 0.73 TSHR (0.41) LMNAMAPTTSHRTDP1CYP2D6
SCHEMBL11056105 0.73 GAA (0.44) LMNATSHRALDH1A1KMT2AHSD17B10
SCHEMBL11055977 0.73 TSHR (0.36) LMNATSHR

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
US-4487781-A HEAT RESISTANCE; PHOTOSTABILITY SANKYO COMPANY LIMITED (JP) 1984-12-11 US disclosed