SCHEMBL10018015

SCHEMBL10018015

CCC(C)(CC)C(=O)NCCCN

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 3/20 0.44
EPHX1 P07099 3/20 0.40
POLB P06746 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GNAI3 P08754 1/20 0.37
GNAO1 P09471 1/20 0.37
GNAI1 P63096 1/20 0.37
DPP7 Q9UHL4 1/20 0.36
RRM1 P23921 1/20 0.35
SLC6A5 Q9Y345 2/20 0.35
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 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
SCHEMBL6807345 0.85 EPHX1 (0.53) EPHX1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL8986779 0.84 PAOX (0.44) PAOXEPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL10024184 0.82 PAOX (0.34) PAOXEPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL9355619 0.81 POLB (0.50) PAOXEPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL16318168 0.80 EPHX1 (0.48) EPHX1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL16189982 0.80 GNAI3 (0.63) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL9499965 0.79 PAOX (0.47) PAOXEPHX1POLBALDH1A1SMN1; SMN2
SCHEMBL14077026 0.79 EPHX1 (0.35) PAOXEPHX1ALDH1A1GNAI3GNAO1
SCHEMBL6812216 0.78 EPHX1 (0.47) EPHX1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL16256508 0.78 PAOX (0.52) PAOXEPHX1POLBALDH1A1SMN1; SMN2

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-20120107264-A1 NUCLEIC ACID DELIVERY COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-05-03 US disclosed
US-20120107264-A1 NUCLEIC ACID DELIVERY COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-05-03 US disclosed
US-7459151-B2 Phosphate-binding polymers for oral administration GENZYME CORPORATION (US) 2008-12-02 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-20120107264-A1 NUCLEIC ACID DELIVERY COMPOUNDS HNRNPH3, NSUN2, SNRPA PAOX 3982/4885EPHX1 4691/4885POLB 83/4885

“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.