SCHEMBL8811522

SCHEMBL8811522

CCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCCOS(C)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
TSHR P16473 2/20 0.52
KDM4E B2RXH2 1/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MMP9 P14780 1/20 0.52
ALOX15 P16050 1/20 0.52
DGKA P23743 1/20 0.52
CA1 P00915 9/20 0.47
CA2 P00918 9/20 0.47
CA9 Q16790 8/20 0.47
CA12 O43570 3/20 0.47
CA7 P43166 3/20 0.47
CA14 Q9ULX7 3/20 0.47
CA3 P07451 2/20 0.47
CA4 P22748 2/20 0.47
CA6 P23280 2/20 0.47
CA5A P35218 2/20 0.47
CA5B Q9Y2D0 2/20 0.47
NAAA Q02083 2/20 0.47

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
SCHEMBL8811515 0.93 ALDH1A1 (0.60) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL16013011 0.88 DGKA (0.65) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL16013124 0.88 DGKA (0.65) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL16023755 0.85 DGKA (0.59) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL1443722 0.83 TSHR (0.75) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL3092383 0.83 TSHR (0.75) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL11748392 0.83 TSHR (0.75) LMNATSHRKDM4EUSP2ALDH1A1
Methanesulfonic Acid Dodecyl Ester SCHEMBL2223590 0.83 TSHR (0.75) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL140845 0.83 TSHR (0.75) LMNATSHRKDM4EUSP2ALDH1A1
SCHEMBL11225069 0.83 TSHR (0.75) LMNATSHRKDM4EUSP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691319-A ANTICARCINOGENIC AGENTS SANKYO COMPANY, LIMITED (JP) 1997-11-25 US disclosed
EP-0536936-B1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use SANKYO CO (JP) 1996-08-14 EP disclosed
EP-0536936-A1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use Sankyo Company Limited (JP) 1993-04-14 EP disclosed