SCHEMBL20580286

SCHEMBL20580286

CC(OC(F)(F)F)C(=O)N1OCC[C@H]1c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 3/20 0.34
SLC6A3 Q01959 5/20 0.33
SLC6A4 P31645 3/20 0.33
ADAMTS5 Q9UNA0 1/20 0.32
SLC6A2 P23975 3/20 0.32
ACHE P22303 1/20 0.32
CCR1 P32246 1/20 0.32
DPP4 P27487 1/20 0.32
DPP9 Q86TI2 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
TRPA1 O75762 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
SCHEMBL20580091 0.85 RIPK1 (0.33)
SCHEMBL22210918 0.85 RIPK1 (0.33)
SCHEMBL22210971 0.85 RIPK1 (0.33)
SCHEMBL18921274 0.84 TRPA1 (0.34) TACR1CCR1DPP4DPP9DPP7
SCHEMBL18921276 0.84 TRPA1 (0.34) TACR1CCR1DPP4DPP9DPP7
SCHEMBL29966743 0.84 TRPA1 (0.34) TACR1CCR1DPP4DPP9DPP7
SCHEMBL18921520 0.84 TRPA1 (0.34) TACR1CCR1DPP4DPP9DPP7
SCHEMBL20580221 0.83 ALDH1A1 (0.42) TACR1CCR1ALDH1A1CYP1A2CYP3A4
SCHEMBL20580157 0.83 ALDH1A1 (0.42) TACR1CCR1ALDH1A1CYP1A2CYP3A4
SCHEMBL22210984 0.80 TRPA1 (0.35) SLC6A3SLC6A4SLC6A2CCR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10709692-B2 Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (RIPK1) DENALI THERAPEUTICS INC. (US) 2020-07-14 US disclosed
US-10709692-B2 Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (RIPK1) DENALI THERAPEUTICS INC. (US) 2020-07-14 US disclosed
US-20180353480-A1 ISOXAZOLIDINE DERIVED INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE 1 (RIPK1) APTUIT (VERONA) S.R.L. (IT) 2018-12-13 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 (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-20180353480-A1 ISOXAZOLIDINE DERIVED INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE 1 (RIPK1) RIPK1, RIPK2, RIPK3 TACR1 3505/4885SLC6A3 4475/4885SLC6A4 4524/4885
US-10709692-B2 Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (RIPK1) RIPK1, RIPK2, RIPK3 TACR1 3505/4885SLC6A3 4475/4885SLC6A4 4524/4885

“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.