SCHEMBL15218276

SCHEMBL15218276

CC(C)(C)OC(=O)NCOCC(COCO)(COCO)COCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CA1 P00915 4/20 0.35
CA2 P00918 3/20 0.35
CA12 O43570 3/20 0.35
CA9 Q16790 2/20 0.35
EPHX1 P07099 1/20 0.35
PTPN11 Q06124 1/20 0.34
CA7 P43166 2/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.32
KDM4A O75164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CTSS P25774 2/20 0.32
CTSK P43235 2/20 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
SCHEMBL15218272 0.86 TDP1 (0.35) TDP1MEN1GAAKMT2A
SCHEMBL16923544 0.78 TDP1 (0.55) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3177993 0.74 TDP1 (0.46) TDP1MEN1GAAKMT2AMAOA
SCHEMBL22939663 0.74 TDP1 (0.46) TDP1MEN1GAAKMT2AMAOA
SCHEMBL17779920 0.73 TDP1 (0.58) TDP1MEN1GAAKMT2AMAOA
SCHEMBL16923542 0.73 TDP1 (0.44) TDP1MEN1GAAKMT2AMAOA
SCHEMBL14978979 0.73 MEN1 (0.46) TDP1MEN1GAAKMT2AMAOA
SCHEMBL8983076 0.73 TDP1 (0.44) TDP1MEN1GAAKMT2AMAOA
SCHEMBL21311602 0.71 TDP1 (0.43) TDP1MEN1GAAKMT2AMAOA
SCHEMBL16013856 0.71 TDP1 (0.43) TDP1MEN1GAAKMT2AMAOA

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
US-20130225789-A1 Polyethylene Glycol Having Hetero Multiple Functional Groups SUN YI (US) 2013-08-29 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-20130225789-A1 Polyethylene Glycol Having Hetero Multiple Functional Groups CLTB, GMFG, HDGF TDP1 4516/4885MEN1 4263/4885GAA 1078/4885

“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.