SCHEMBL18502229

SCHEMBL18502229

CCN(CC)CC(C)OOC(C)CN(CC)CC

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
KMT2A Q03164 1/20 0.35
PLA2G1B P04054 1/20 0.33
PLA2G2A P14555 1/20 0.33

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
SCHEMBL2456181 0.82 MAPK1 (0.36) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL2016329 0.80 KMT2A (0.38) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL18507946 0.78 SCN1A (0.33) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL18507948 0.78 LMNA (0.41) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL10407571 0.78 SCN1A (0.33) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL17475504 0.76 SCN1A (0.33) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL17475527 0.76 SCN1A (0.33) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL18652679 0.76 SCN1A (0.33) SCN1ASCN2ASCN3AKMT2APLA2G1B
SCHEMBL18502210 0.74
SCHEMBL18502215 0.74 PIK3CD (0.31)

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-20170044188-A1 COPPER COMPOUND, STARTING MATERIAL FOR FORMING THIN FILM, AND METHOD FOR MANUFACTURING THIN FILM ADEKA CORPORATION (JP) 2017-02-16 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-20170044188-A1 COPPER COMPOUND, STARTING MATERIAL FOR FORMING THIN FILM, AND METHOD FOR MANUFACTURING THIN FILM C5, C9, C1R SCN1A 2576/4885SCN2A 3793/4885SCN3A 3546/4885

“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.