SCHEMBL14873221

SCHEMBL14873221

CCCC(CCC)NCCOCCOCCOCCOC

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
RECQL P46063 1/20 0.34
SLC6A4 P31645 1/20 0.34
CA2 P00918 1/20 0.32
ABCB11 O95342 1/20 0.31
CYP3A4 P08684 1/20 0.31
ADRA2B P18089 1/20 0.31
OPRD1 P41143 1/20 0.31
SCN5A Q14524 1/20 0.31
TAS1R3 Q7RTX0 2/20 0.30
TAS1R1 Q7RTX1 2/20 0.30

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
SCHEMBL24861374 0.92 MEN1 (0.33) KDM4E
SCHEMBL24171293 0.87 SLC6A4 (0.41) KDM4ESLC6A4TAS1R3TAS1R1
SCHEMBL1277087 0.83 SLC6A4 (0.42) KDM4ERECQLSLC6A4CA2
SCHEMBL15463288 0.82 KDM4E (0.35) KDM4ERECQLSLC6A4CA2ABCB11
SCHEMBL13976255 0.76 MEN1 (0.41)
SCHEMBL12737483 0.76 CYP3A4 (0.35) KDM4ERECQLSLC6A4CA2ABCB11
SCHEMBL24861284 0.76 KDM4E (0.37) KDM4E
SCHEMBL25083919 0.74 CYP3A4 (0.37) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL21839006 0.74 KDM4E (0.40) KDM4ERECQLSLC6A4CA2
SCHEMBL22861638 0.74 KDM4E (0.40) KDM4ERECQLSLC6A4CA2

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-20130096088-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2013-04-18 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-20130096088-A1 Inhibitors of Protein Tyrosine Kinase Activity KDR, FLT1, FLT4 KDM4E 3367/4885RECQL 3115/4885SLC6A4 3873/4885

“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.