SCHEMBL25224840

SCHEMBL25224840

C=CCOCCOC(C)OC(C)OC(C)O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL25233651 0.96 MEN1 (0.36) MEN1POLBKMT2ACA1CA2
SCHEMBL22712840 0.83 CA1 (0.31) CA1CA2CA7
SCHEMBL22712843 0.83 CA1 (0.31) CA1CA2CA7
SCHEMBL1785606 0.81 CA1 (0.41) MEN1POLBKMT2ACA1CA2
SCHEMBL8940424 0.80 CA1 (0.39) MEN1POLBKMT2ACA1CA2
SCHEMBL1785605 0.79 CA1 (0.33) CA1CA2CA7TDP1
SCHEMBL3160014 0.79
SCHEMBL3163329 0.74
SCHEMBL29117485 0.74 ALDH1A1 (0.37) TDP1
SCHEMBL2202152 0.73 MEN1 (0.43) MEN1POLBKMT2ACA1CA2

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-3976362-B1 METHOD FOR MAKING OPAQUE COLORED SILICONE HYDROGEL CONTACT LENSES ALCON INC (CH) 2023-06-07 EP claimed