SCHEMBL13640440

SCHEMBL13640440

COC(=O)C(C)CCCC(C)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.45
CA2 P00918 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
ZDHHC7 Q9NXF8 1/20 0.42
BLM P54132 1/20 0.41
CA14 Q9ULX7 2/20 0.39
CA12 O43570 1/20 0.37
TSHR P16473 2/20 0.36
ABCB1 P08183 1/20 0.36
KMT2A Q03164 1/20 0.35
BIRC2 Q13490 1/20 0.34
ESRRB O95718 1/20 0.34
FOLH1 Q04609 1/20 0.34

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
SCHEMBL11611500 0.93 BLM (0.52) CA1CA2SMN1; SMN2ZDHHC7BLM
SCHEMBL994205 0.93 BLM (0.52) CA1CA2SMN1; SMN2ZDHHC7BLM
SCHEMBL11600011 0.93 BLM (0.52) CA1CA2SMN1; SMN2ZDHHC7BLM
SCHEMBL7105090 0.89 SMN1; SMN2 (0.46) CA1CA2SMN1; SMN2ZDHHC7CA14
SCHEMBL15779692 0.89 CA1 (0.42) CA1CA2SMN1; SMN2ZDHHC7BLM
SCHEMBL2779851 0.88 CA1 (0.61) CA1CA2ZDHHC7TSHRABCB1
SCHEMBL7947656 0.88 CA1 (0.61) CA1CA2ZDHHC7TSHRABCB1
SCHEMBL11298047 0.88 CA1 (0.61) CA1CA2ZDHHC7TSHRABCB1
SCHEMBL11602158 0.87 BLM (0.62) CA1CA2SMN1; SMN2ZDHHC7BLM
SCHEMBL9808025 0.87 CA1 (0.46) CA1CA2SMN1; SMN2ZDHHC7BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9751880-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, and imide compound CANON KABUSHIKI KAISHA (JP) 2017-09-05 US disclosed
US-9751880-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, and imide compound CANON KABUSHIKI KAISHA (JP) 2017-09-05 US disclosed
US-20160115163-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND IMIDE COMPOUND CANON KABUSHIKI KAISHA (JP) 2016-04-28 US disclosed
US-20120282386-A1 LANTHIONINE DERIVATIVES AJINOMOTO CO., INC. (JP) 2012-11-08 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 (2 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-20160115163-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND IMIDE COMPOUND PPIE, PPIG, PPIA CA1 3064/4885CA2 2676/4885SMN1; SMN2 4207/4885
US-20120282386-A1 LANTHIONINE DERIVATIVES CASR, KCNJ5, CALCR CA1 522/4885CA2 92/4885SMN1; SMN2 4021/4885

“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.