SCHEMBL6281714

SCHEMBL6281714

CC(C)CC(N)c1cc(F)c(F)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 7/20 0.33
DPP4 P27487 1/20 0.32
ALDH1A1 P00352 3/20 0.31
MAPK1 P28482 2/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
HTT P42858 2/20 0.31
HSD17B10 Q99714 2/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MC4R P32245 1/20 0.31
PDE2A O00408 1/20 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
SCHEMBL6286067 0.84
SCHEMBL6284491 0.77 PDE2A (0.42) DPP4LMNAHTTPDE2A
SCHEMBL6283821 0.77 CFD (0.32)
SCHEMBL2016761 0.72 EIF4A3 (0.35) DPP4
SCHEMBL13995189 0.72 PDE2A (0.40) DPP4ALDH1A1MAPK1LMNAMAPT
SCHEMBL13995180 0.72 CFD (0.41) AAK1ALDH1A1LMNAMAPTHTT
SCHEMBL13995160 0.71 CYP3A4 (0.41) ALDH1A1MAPTMC4R
SCHEMBL16292877 0.71 CYP3A4 (0.41) ALDH1A1MAPTMC4R
SCHEMBL7872543 0.70 CES2 (0.32)
SCHEMBL19304406 0.69 TSHR (0.38) TSHRPDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919291-B2 Fluorinated zwitterionic cocatalyst activators for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-07-19 US disclosed
US-20040110631-A1 Fluorinated zwitterionic cocatalyst activators for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2004-06-10 US disclosed
EP-1349653-A2 FLUORINATED ZWITTERIONIC COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION ExxonMobil Chemical Patents Inc. (US) 2003-10-08 EP disclosed
WO-2002036639-A2 FLUORINATED ZWITTERIONIC COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2002-05-10 WO 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-20040110631-A1 Fluorinated zwitterionic cocatalyst activators for olefin polymerization FZD7, FOS, COG4 AAK1 1734/4885DPP4 4615/4885ALDH1A1 3691/4885

“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.