SCHEMBL20560610

SCHEMBL20560610

O=C(OC(=O)c1cccc(S(F)(F)(F)(F)F)c1)c1cccc(S(F)(F)(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 3/20 0.50
▸ AKR1C2 P52895 3/20 0.50
▸ PTGS1 P23219 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ TAS2R14 Q9NYV8 1/20 0.40
▸ CES2 O00748 2/20 0.36
▸ CES1 P23141 2/20 0.36
▸ ESR1 P03372 2/20 0.36
▸ ESR2 Q92731 2/20 0.36
▸ LOXL2 Q9Y4K0 1/20 0.35
▸ KDM1A O60341 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ F2 P00734 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ CYP4F2 P78329 1/20 0.34
▸ CYP4A11 Q02928 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SLC2A1 P11166 1/20 0.34

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
SCHEMBL21585232 0.81 CYP4F2 (0.52) PKMCYP4F2CYP4A11NPC1RAB9A
SCHEMBL1169066 0.80 AKR1C3 (0.72) AKR1C3AKR1C2PTGS1PTGS2TAS2R14
SCHEMBL1195462 0.78 AKR1C3 (0.51) AKR1C3AKR1C2PTGS1PTGS2TAS2R14
SCHEMBL477610 0.78 AKR1C3 (0.51) AKR1C3AKR1C2PTGS1PTGS2TAS2R14
SCHEMBL20560502 0.75 AKR1C3 (0.39) AKR1C3AKR1C2PTGS1ESR1ESR2
SCHEMBL1194372 0.74 GSK3B (0.52) AKR1C3AKR1C2PTGS1PTGS2TAS2R14
SCHEMBL23430506 0.74 KMT2A (0.54) AKR1C3AKR1C2ESR1ESR2PKM
SCHEMBL5649611 0.74 CES2 (0.65) CES2CES1ESR1ESR2PKM
SCHEMBL545343 0.73 LMNA (0.58) AKR1C3CES2CES1F2LMNA
Isophthalic Acid SCHEMBL20500517 0.71 CA12 (0.56) AKR1C3PKMKMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116354830-A Process for the preparation of functionalized fluorinated monomers, fluorinated monomers and compositions for the preparation thereof 埃特纳科技有限公司 2023-06-30 — — CN disclosed
CN-110770271-B Method for preparing functionalized fluorinated monomers, fluorinated monomers and compositions for preparing same 埃特纳科技有限公司 2023-04-18 — — CN disclosed
US-20220213016-A1 Methods for Making Functionalized Fluorinated Monomers, Fluorinated Monomers, and Compositions for Making the Same ETNA-TEC, LTD. 2022-07-07 — — US disclosed
EP-3635022-A1 METHODS FOR MAKING FUNCTIONALIZED FLUORINATED MONOMERS, FLUORINATED MONOMERS, AND COMPOSITIONS FOR MAKING THE SAME Etna-Tec, Ltd (US) 2020-04-15 — — EP disclosed
CN-110770271-A Method for preparing functionalized fluorinated monomers, fluorinated monomers and compositions for preparing same 埃特纳科技有限公司 2020-02-07 — — CN disclosed
US-20180334416-A1 Methods for Making Functionalized Fluorinated Monomers, Fluorinated Monomers, and Compositions for Making the Same ETNA-TEC, LTD. 2018-11-22 — — US disclosed
WO-2018213850-A1 METHODS FOR MAKING FUNCTIONALIZED FLUORINATED MONOMERS, FLUORINATED MONOMERS, AND COMPOSITIONS FOR MAKING THE SAME ETNA-TEC, LTD (US) 2018-11-22 — — WO disclosed
US-20180334417-A1 Methods for Making Functionalized Fluorinated Monomers, Fluorinated Monomers, and Compositions for Making the Same ETNA-TEC, LTD. 2018-11-22 — — 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 (3 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-20180334417-A1 Methods for Making Functionalized Fluorinated Monomers, Fluorinated Monomers, and Compositions for Making the Same ALKBH3, FTO, THEM6 AKR1C3 376/4885AKR1C2 304/4885PTGS1 2145/4885
US-20220213016-A1 Methods for Making Functionalized Fluorinated Monomers, Fluorinated Monomers, and Compositions for Making the Same ALKBH3, FTO, ALK AKR1C3 373/4885AKR1C2 302/4885PTGS1 2188/4885
US-20180334416-A1 Methods for Making Functionalized Fluorinated Monomers, Fluorinated Monomers, and Compositions for Making the Same ALKBH3, FTO, ALK AKR1C3 373/4885AKR1C2 302/4885PTGS1 2188/4885

“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.

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