SCHEMBL21165829

SCHEMBL21165829

CCOP(=O)(N(C)C)N(C)CC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.36
TSHR P16473 2/20 0.33
PPARD Q03181 2/20 0.31
ALOX15 P16050 1/20 0.31
TP53 P04637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL25978877 0.84
SCHEMBL15087751 0.81
SCHEMBL15182435 0.76 CTSA (0.30) ACHE
SCHEMBL8650070 0.75 TSHR (0.50) ACHETSHRPPARDTP53TDP1
SCHEMBL11861492 0.71 PPARD (0.43) ACHETSHRPPARDTP53TDP1
SCHEMBL3097323 0.70 TSHR (0.40) ACHETSHRPPARDALOX15TP53
SCHEMBL16562635 0.70
SCHEMBL10597368 0.69 FDPS (0.32) ALOX15
SCHEMBL10389565 0.66 TSHR (0.40) TSHRPPARDALOX15TP53TDP1
SCHEMBL23652502 0.66 ACHE (0.35) ACHETSHRPPARDALOX15TP53

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-20190218244-A1 ANTISENSE NUCLEIC ACIDS NIPPON SHINYAKU CO., LTD. (JP) 2019-07-18 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-20190218244-A1 ANTISENSE NUCLEIC ACIDS UTRN, RBM17, UPF1 ACHE 4181/4885TSHR 3246/4885PPARD 2400/4885

“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.