SCHEMBL14564009

SCHEMBL14564009

CCc1cc2c(cc1O)OC1(CC2(C)C)CC(C)(C)c2cc(CC)c(O)cc2O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 2/20 0.46
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MCL1 Q07820 1/20 0.33
HSP90AA1 P07900 3/20 0.32
RXRA P19793 2/20 0.32
AKR1B1 P15121 2/20 0.31
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL31232341 0.84 FTO (0.51) FTOALDH1A1
SCHEMBL2548277 0.84 FTO (0.51) FTOALDH1A1
SCHEMBL14563981 0.83 FTO (0.68) FTOCNR2ALDH1A1HPGDKDM4E
SCHEMBL15867102 0.81 TYR (0.40) FTOCNR2ALDH1A1HPGDKDM4E
SCHEMBL13607193 0.80 FTO (0.48) FTOALDH1A1HPGDKDM4EMAPT
SCHEMBL16601851 0.77 FTO (0.46) FTOALDH1A1HPGDKDM4EMAPT
SCHEMBL12997667 0.77 FTO (0.46) FTOALDH1A1HPGDKDM4EMAPT
SCHEMBL3615121 0.77 FTO (0.44) FTOALDH1A1HPGDKDM4EMAPT
SCHEMBL30471544 0.77 FTO (0.44) FTOALDH1A1HPGDKDM4EMAPT
SCHEMBL9327955 0.75 FTO (0.61) FTOALDH1A1HPGDTSHRHSD17B10

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-1613682-B1 ULTRA-RAMIFIED POLYCARBONATES AND COPOLYCOARBONATES EXHIBITING AN IMPROVED FLOW CHARACTERISTICS, THE PRODUCTION AND USE THEREOF BAYER MATERIALSCIENCE AG (DE) 2007-03-14 EP disclosed