SCHEMBL6283299

SCHEMBL6283299

Fc1cccc(-c2c(F)c(F)c3c(F)c(F)c4c(F)c(F)c(F)c5c(F)c(F)c2c3c45)c1F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.35
BCAT1 P54687 1/20 0.33
CES2 O00748 1/20 0.33
BCHE P06276 1/20 0.33
CES1 P23141 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
HSD11B1 P28845 1/20 0.32
SLC9A1 P19634 1/20 0.30
PDK2 Q15119 1/20 0.30
KIF11 P52732 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
SCHEMBL5949036 0.84 DHODH (0.43) DHODHBCAT1CES2BCHECES1
SCHEMBL6283451 0.81 CES2 (0.31) CES2CES1
SCHEMBL25277618 0.74 DHODH (0.40) DHODHBCAT1CES2BCHECES1
SCHEMBL3038641 0.74 CES2 (0.46) BCAT1CES2BCHECES1CA1
SCHEMBL29006462 0.73 PDK2 (0.41) DHODHCES2BCHECES1CA1
SCHEMBL25224763 0.72 WDR5 (0.42) DHODHBCAT1CES2BCHECES1
SCHEMBL6285468 0.71 CES2 (0.33) CES2CES1
SCHEMBL6284288 0.71 CA1 (0.33) DHODHBCAT1CES2BCHECES1
SCHEMBL23531226 0.70 BCAT1 (0.39) DHODHBCAT1CES2BCHECES1
SCHEMBL12014489 0.69

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-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

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 DHODH 3841/4885BCAT1 1238/4885CES2 1566/4885

“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.