SCHEMBL12675894

SCHEMBL12675894

O=C(/C=C/c1ccc(-c2ccc(-c3ccccc3)cc2)cc1)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 6/20 0.58
▸ MGLL Q99685 2/20 0.55
▸ PRKAG1 P54619 2/20 0.42
▸ PRKAA1 Q13131 2/20 0.42
▸ PRKAB1 Q9Y478 2/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ PRKAB2 O43741 1/20 0.40
▸ PRKAA2 P54646 1/20 0.40
▸ PRKAG3 Q9UGI9 1/20 0.40
▸ PRKAG2 Q9UGJ0 1/20 0.40
▸ MCL1 Q07820 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL12675214 1.00 BCHE (0.58) BCHEMGLLPRKAG1PRKAA1PRKAB1
SCHEMBL12675213 1.00 BCHE (0.58) BCHEMGLLPRKAG1PRKAA1PRKAB1
SCHEMBL2888975 0.93 BCHE (0.66) BCHEMGLLHDAC2MCL1
SCHEMBL10423625 0.93 BCHE (0.66) BCHEMGLLHDAC2MCL1
SCHEMBL2888973 0.93 BCHE (0.66) BCHEMGLLHDAC2MCL1
SCHEMBL17705954 0.86 BCHE (0.63) BCHEHDAC2HSD17B10
SCHEMBL14348553 0.86 BCHE (0.63) BCHEHDAC2HSD17B10
SCHEMBL16661395 0.86 BCHE (0.63) BCHEHDAC2HSD17B10
SCHEMBL5630321 0.86 BCHE (0.63) BCHEHDAC2HSD17B10
SCHEMBL19821134 0.86 BCHE (0.73) BCHEMGLLHDAC2

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-20110117295-A1 OPTICALLY ANISOTOPIC FILM, PROCESS FOR PRODUCING OPTICALLY ANISOTOPIC FILM, SUBSTRATE FOR LIQUID CRYSTAL CELL, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2011-05-19 — — US disclosed
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