SCHEMBL12013286

SCHEMBL12013286

O=C(CN(CC(=O)NCCOCCOCCOCCOCc1ccccc1)C(=O)COCC(COC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(COC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)COC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)NCCOCCOCCOCCOCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.39
APP P05067 1/20 0.38
HRAS P01112 1/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
ASAH1 Q13510 2/20 0.34
FGF1 P05230 2/20 0.33
FGF2 P09038 2/20 0.33
EPOR P19235 4/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GHSR Q92847 1/20 0.33
EPHX2 P34913 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL12013289 0.98 SMN1; SMN2 (0.38) SMN1; SMN2LMNAHTTAPPHRAS
SCHEMBL12013282 0.90 SMN1; SMN2 (0.44) SMN1; SMN2LMNAHTTASAH1EPOR
SCHEMBL12616348 0.87 SMN1; SMN2 (0.42) SMN1; SMN2LMNAHTTAPPHRAS
SCHEMBL12616615 0.85 SMN1; SMN2 (0.40) SMN1; SMN2LMNAHTTAPPHRAS
SCHEMBL12013292 0.85 APP (0.37) APP
SCHEMBL12013352 0.84 APP (0.36) APP
SCHEMBL12013348 0.82 APP (0.35) APP
SCHEMBL12013347 0.82 APP (0.35) APP
SCHEMBL12292984 0.78 APP (0.35) SMN1; SMN2LMNAHTTAPPHRAS
SCHEMBL12013299 0.77 TSHR (0.41) SMN1; SMN2HTTALDH1A1

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-8252778-B2 Highly fluorinated oils and surfactants and methods of making and using same UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2012-08-28 US disclosed
US-20090264397-A1 HIGHLY FLUORINATED OILS AND SURFACTANTS AND METHODS OF MAKING AND USING SAME NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-10-22 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-20090264397-A1 HIGHLY FLUORINATED OILS AND SURFACTANTS AND METHODS OF MAKING AND USING SAME FLOT1, ABCB4, SGMS1 SMN1; SMN2 2088/4885LMNA 1143/4885HTT 1438/4885

“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.