SCHEMBL17864869

SCHEMBL17864869

COC(OC)c1ccccc1C(OC)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.40
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA4 P22748 2/20 0.38
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
ACHE P22303 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CDC25A P30304 2/20 0.36
CDC25B P30305 2/20 0.36
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
LMNA P02545 2/20 0.36

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
SCHEMBL2354738 0.89 GABRA1 (0.46) ESR1CA1CA2SLC6A2ACHE
SCHEMBL6258936 0.86 MAPT (0.48) ESR1CA1CA2CA4CA12
SCHEMBL28368759 0.85 CYP2D6 (0.42) CA1CA2ACHEALDH1A1KDM4E
SCHEMBL451129 0.84 ESR1 (0.34) ESR1CA1CA2CA4CA12
SCHEMBL1918798 0.84 CA1 (0.57) CA1CA2CA4CA12CA7
SCHEMBL3206497 0.84 ESR1 (0.56) ESR1CA1CA2CA7CA9
SCHEMBL3213376 0.82 ESR1 (0.33) ESR1CA1CA2CA4CA12
SCHEMBL2220996 0.82 IDO1 (0.44) SLC6A2SLC6A4SLC6A3ALDH1A1KDM4E
SCHEMBL5142961 0.82 GABRA1 (0.56) CA1CA2CA4CA12CA7
SCHEMBL28364985 0.82 SLC6A2 (0.35) ESR1CA1CA2CA4CA12

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-20160178809-A1 POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE, AND DISPLAY FUJIFILM CORPORATION (JP) 2016-06-23 US disclosed