SCHEMBL8056360

SCHEMBL8056360

CCOC(=O)c1ccc2c(C(=O)OCC)cccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 5/20 0.58
TSHR P16473 1/20 0.54
CA12 O43570 3/20 0.51
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA7 P43166 3/20 0.51
CA9 Q16790 3/20 0.51
CA14 Q9ULX7 3/20 0.51
PTPN1 P18031 1/20 0.51
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.51
CDC25A P30304 2/20 0.51
CDC25C P30307 2/20 0.51
RAB9A P51151 2/20 0.49
MEN1 O00255 1/20 0.49
HCRTR1 O43613 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.48

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
SCHEMBL8912608 0.86 CDC25B (0.60) CDC25BTSHRCA12CA1CA2
SCHEMBL27593647 0.86 TSHR (0.59) TSHRALDH1A1KDM4ERAB9ASMN1; SMN2
SCHEMBL69303 0.85 TSHR (0.63) CDC25BTSHRCA12CA1CA2
SCHEMBL2116049 0.85 CDC25B (0.58) CDC25BTSHRCA12CA1CA2
SCHEMBL10392247 0.84 CDC25B (0.56) CDC25BCA12CA1CA2CA7
SCHEMBL6297205 0.84 CDC25B (0.57) CDC25BTSHRALDH1A1KDM4ECDC25A
SCHEMBL9518903 0.84 SLC9A1 (0.52) CDC25BCA12CA1CA2CA7
SCHEMBL15935996 0.83 CDC25B (0.60) CDC25BTSHRCA12CA1CA2
SCHEMBL11272281 0.82 CDC25B (0.60) CDC25BTSHRCA12CA2CA7
Hydrochloric Acid SCHEMBL6987956 0.82 CDC25B (0.56) CDC25BTSHRALDH1A1KDM4ECDC25A

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-0635757-B1 A process for making PET photographic film base with improved curl stability EASTMAN KODAK CO (US) 2000-05-17 EP disclosed