SCHEMBL26428754

SCHEMBL26428754

COC(=O)c1cc(OCC2COC(C)(C)O2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.46
CA2 P00918 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CCNK O75909 1/20 0.38
CDK12 Q9NYV4 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
SCHEMBL8662264 0.89 MAPK14 (0.42) MAPK14CA2CCNKCDK12
SCHEMBL27456767 0.89 MAPK14 (0.42) MAPK14CA2CCNKCDK12
SCHEMBL26427763 0.88 MAPK14 (0.46) MAPK14CA2
SCHEMBL5467053 0.85 MAPK14 (0.44) MAPK14
SCHEMBL22056912 0.85 MAPK14 (0.50) MAPK14CA2CCNKCDK12
SCHEMBL7092195 0.84 TSHR (0.49) CA2CA12CA1CA7CA9
SCHEMBL9149708 0.82 MAPT (0.50) MAPK14CA2CA1
SCHEMBL1587316 0.82 MAPK14 (0.44) MAPK14
SCHEMBL1587319 0.82 MAPK14 (0.44) MAPK14
SCHEMBL1075429 0.81 MAPK14 (0.45) MAPK14

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
WO-2023189502-A1 RADIATION-SENSITIVE COMPOSITION, PATTERN FORMATION METHOD, AND PHOTODEGRADABLE BASE JSR株式会社 2023-10-05 WO disclosed