SCHEMBL13004261

SCHEMBL13004261

CC/C=C\CC(=O)NCNC(=O)C/C=C\CC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.39
CNR1 P21554 4/20 0.39
FAAH O00519 2/20 0.39
OXER1 Q8TDS5 5/20 0.34
MAPT P10636 4/20 0.34
CYP19A1 P11511 3/20 0.34
PPARG P37231 3/20 0.34
RXRA P19793 2/20 0.34
FFAR1 O14842 2/20 0.34
EPHX2 P34913 2/20 0.33
KMT2A Q03164 3/20 0.32
F7 P08709 3/20 0.32
F3 P13726 3/20 0.32
PPARA Q07869 3/20 0.32
PTGS1 P23219 2/20 0.32
PPARD Q03181 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL13562877 0.80 CNR1 (0.61) ALDH1A1CNR1FAAHMAPTKMT2A
SCHEMBL14752449 0.80 ALDH1A1 (0.36) ALDH1A1CNR1FAAHOXER1MAPT
SCHEMBL15131732 0.80 MEN1 (0.52) ALDH1A1CNR1EPHX2KMT2AMAPK1
SCHEMBL13562881 0.79 CNR1 (0.42) ALDH1A1CNR1FAAHMAPTEPHX2
SCHEMBL5323744 0.79 CNR1 (0.49) CNR1EPHX2KMT2AMEN1
SCHEMBL5323738 0.79 CNR1 (0.49) CNR1EPHX2KMT2AMEN1
SCHEMBL19661057 0.78 MEN1 (0.45) ALDH1A1CNR1EPHX2KMT2AMEN1
SCHEMBL12267828 0.78
SCHEMBL10584847 0.78
SCHEMBL15951430 0.76 CNR1 (0.70) ALDH1A1CNR1FAAHMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846972-B2 Multimeric oleamide derivative having connexin-26 inhibiting potency and use thereof in cancer therapy, etc The New Industrial Research Organization (JP) 2010-12-07 US disclosed
US-20080089924-A1 Multimeric Oleamide Derivative Having Connexin-26 Inhibiting Potency and Use Thereof in Cancer Therapy, etc. THE RITSUMEIKAN TRUST (JP) 2008-04-17 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-20080089924-A1 Multimeric Oleamide Derivative Having Connexin-26 Inhibiting Potency and Use Thereof in Cancer Therapy, etc. GJA1, GJB2, SLC26A3 ALDH1A1 1285/4885CNR1 302/4885FAAH 1281/4885

“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.