SCHEMBL17852127

SCHEMBL17852127

CCOC(=O)c1c(Br)cccc1-c1cc2ccccc2c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.51
PTGES O14684 3/20 0.51
CDC25B P30305 6/20 0.46
CDC25A P30304 2/20 0.46
CDC25C P30307 2/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
GLA P06280 2/20 0.43
GAA P10253 2/20 0.43
KMT2A Q03164 4/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 3/20 0.42
PRNP P04156 1/20 0.42

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
SCHEMBL17852134 0.88 CDC25B (0.52) ALOX5PTGESCDC25BCDC25ACDC25C
SCHEMBL17852141 0.81 SLC6A2 (0.49) ALOX5PTGESCA12CA1CA2
SCHEMBL17852148 0.78 ALDH1A1 (0.49) ALOX5PTGESCDC25BCDC25ACDC25C
SCHEMBL11237854 0.78 CA12 (0.66) ALOX5PTGESCA12CA1CA2
SCHEMBL27553344 0.77 CDC25B (0.52) CDC25BCDC25ACDC25CCA12CA1
SCHEMBL5835576 0.77 CA12 (0.55) ALOX5CDC25BCDC25ACDC25CCA12
SCHEMBL15505863 0.75 CDC25B (0.48) CDC25BCDC25ACDC25CCA12CA1
SCHEMBL19628183 0.75 CDC25B (0.51) CDC25BCDC25ACDC25CKDM4EALDH1A1
SCHEMBL14141531 0.74 TSHR (0.59) CDC25BCDC25ACDC25CKDM4EALDH1A1
SCHEMBL4470759 0.74 CA12 (0.59) ALOX5PTGESCA12CA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 US disclosed
US-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME L1CAM, H1-10, H1-0 ALOX5 504/4885PTGES 2585/4885CDC25B 3875/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.