SCHEMBL6004388

SCHEMBL6004388

CC(F)(COCC1CO1)C1CCC(C(C)(F)COCC2CO2)CC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.60
MAPK1 P28482 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 6/20 0.44
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 3/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
PPARG P37231 1/20 0.34
HIF1A Q16665 1/20 0.34
CYP3A4 P08684 1/20 0.33

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
SCHEMBL11953272 0.80 TSHR (0.69) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL12169623 0.77 TSHR (0.64) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL36455 0.76 TSHR (1.00) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL16854634 0.76 TSHR (0.61) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL13558703 0.76 TSHR (0.75) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL551254 0.76 TSHR (0.75) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL18290484 0.76 TSHR (0.61) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL1320955 0.76 TSHR (0.61) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL2547812 0.76 TSHR (0.61) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL260117 0.76 TSHR (0.75) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1645943-B2 FORGERY PREVENTING LABEL AND METHOD OF MANUFACTURING THE SAME DAINIPPON PRINTING CO LTD (JP) 2021-01-13 EP disclosed
EP-1645943-B1 FORGERY PREVENTING LABEL AND METHOD OF MANUFACTURING THE SAME DAINIPPON PRINTING CO LTD (JP) 2013-09-11 EP disclosed
EP-1645943-A1 FORGERY PREVENTING LABEL AND METHOD OF MANUFACTURING THE SAME DAI NIPPON PRINTING CO., LTD. (JP) 2006-04-12 EP disclosed