SCHEMBL17355378

SCHEMBL17355378

O=C(/C=C/c1ccccc1)OCC(COCCC(F)(F)F)(COC(=O)/C=C/c1ccccc1)COC(=O)/C=C/c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKR1B10 O60218 6/20 0.51
AKR1B1 P15121 6/20 0.51
LMNA P02545 1/20 0.50
ALDH1A1 P00352 1/20 0.47
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
APP P05067 1/20 0.44
MAOB P27338 1/20 0.44
CA12 O43570 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
RAB9A P51151 2/20 0.42
HTT P42858 1/20 0.40

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
SCHEMBL32687952 0.86 LMNA (0.65) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL17355364 0.86 LMNA (0.65) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL17355379 0.81 AKR1B10 (0.48) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL17355359 0.81 LMNA (0.55) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL17355380 0.80 LMNA (0.51) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL15428040 0.79 LMNA (0.59) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL11146534 0.75 LMNA (0.63) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL11146531 0.75 LMNA (0.63) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL19279512 0.75 AKR1B10 (0.83) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL16234738 0.75 AKR1B10 (0.83) AKR1B10AKR1B1LMNAALDH1A1MEN1

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-2957610-A1 DEBONDABLE ADHESIVE COMPOSITION NITTO DENKO CORPORATION (JP) 2015-12-23 EP disclosed