SCHEMBL3278359

SCHEMBL3278359

COC(=O)c1ccc(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 2/20 0.51
CYP4F2 P78329 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.47
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
CYP2C19 P33261 1/20 0.44
CKS1B P61024 1/20 0.44
SKP2 Q13309 1/20 0.44
HIF1A Q16665 1/20 0.44
HSD17B10 Q99714 1/20 0.44
IDH1 O75874 1/20 0.42
CCR6 P51684 1/20 0.42
HKDC1 Q2TB90 1/20 0.42
LMNA P02545 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
SCHEMBL8337316 0.82 CYP4A11 (0.60) CYP4A11CYP4F2LOXL2HPGDALDH1A1
SCHEMBL19922867 0.81 CYP4A11 (0.64) CYP4A11CYP4F2LOXL2HPGDALDH1A1
SCHEMBL316846 0.78 MLYCD (0.52) HPGDALDH1A1LMNAMAPTMEN1
SCHEMBL7154419 0.77 TAAR1 (0.46) MAPTMEN1KMT2A
SCHEMBL19002551 0.77 CYP4A11 (0.62) CYP4A11CYP4F2LOXL2HPGDALDH1A1
SCHEMBL880015 0.76 CYP4A11 (0.66) CYP4A11CYP4F2LOXL2HPGDALDH1A1
SCHEMBL70185 0.76 CYP4A11 (0.75) CYP4A11CYP4F2LOXL2HPGDALDH1A1
SCHEMBL19922221 0.75 CYP4A11 (0.60) CYP4A11CYP4F2LOXL2HPGDALDH1A1
SCHEMBL3426890 0.75 CA2 (0.35) CA1CA2
SCHEMBL12727813 0.75 CYP1A2 (0.41) ALDH1A1CYP1A2ALOX15MAPTCA1

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-20100087634-A1 Fluorous Oligonucleotide Reagents and Affinity Purification of Oligonucleotides BERRY & ASSOCIATES, INC. (US) 2010-04-08 US disclosed
EP-1831238-A2 FLUOROUS OLIGONUCLEOTIDE REAGENTS AND AFFINITY PURIFICATION OF OLIGONUCLEOTIDES Berry & Associates , Inc. (US) 2007-09-12 EP disclosed
US-20060178507-A1 Fluorous oligonucleotide reagents and affinity purification of oligonucleotides BERRY & ASSOCIATES, INC. 2006-08-10 US disclosed
WO-2006081035-A2 FLUOROUS OLIGONUCLEOTIDE REAGENTS AND AFFINITY PURIFICATION OF OLIGONUCLEOTIDES BERRY & ASSOCIATES, INC. (US) 2006-08-03 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 (2 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-20060178507-A1 Fluorous oligonucleotide reagents and affinity purification of oligonucleotides DCLRE1B, POLM, FBL CYP4A11 4662/4885CYP4F2 2181/4885LOXL2 2206/4885
US-20100087634-A1 Fluorous Oligonucleotide Reagents and Affinity Purification of Oligonucleotides DCLRE1B, POLM, FBL CYP4A11 4662/4885CYP4F2 2181/4885LOXL2 2206/4885

“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.