SCHEMBL10046349

SCHEMBL10046349

CCCCCCNC(=O)NCCCCCCNC(=O)NCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 13/20 0.59
EPHX2 P34913 6/20 0.43
CASP2 P42575 1/20 0.42

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
SCHEMBL10046413 1.00 EPHX1 (0.59) EPHX1EPHX2CASP2
SCHEMBL13063728 0.93 EPHX1 (0.51) EPHX1EPHX2CASP2
SCHEMBL13063698 0.85 CASP2 (0.56) EPHX1EPHX2CASP2
SCHEMBL13827121 0.85 GBA1 (0.33) EPHX1
SCHEMBL16473143 0.84 EPHX1 (0.44) EPHX1EPHX2
SCHEMBL21243822 0.78 EPHX1 (0.55) EPHX1EPHX2CASP2
SCHEMBL25278283 0.77 EPHX1 (1.00) EPHX1EPHX2CASP2
SCHEMBL25225212 0.77 EPHX1 (1.00) EPHX1EPHX2CASP2
SCHEMBL25276783 0.77 EPHX1 (1.00) EPHX1EPHX2CASP2
SCHEMBL25228721 0.77 EPHX1 (1.00) EPHX1EPHX2CASP2

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-20120009840-A1 PARTIALLY FLUORINATED UREAS AND AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-01-12 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-20120009840-A1 PARTIALLY FLUORINATED UREAS AND AMIDES NAF1, FBL, UMPS EPHX1 1825/4885EPHX2 1259/4885CASP2 2584/4885

“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.