SCHEMBL21577565

SCHEMBL21577565

CC(C)(C)C(=O)N1CC(F)(F)OC(F)(F)C1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.33
RIPK1 Q13546 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL20434827 0.89 EPHX2 (0.31) EPHX2
SCHEMBL10202606 0.80 DPP4 (0.35) EPHX2RIPK1MEN1KMT2A
SCHEMBL15490630 0.78 RORC (0.33) EPHX2RIPK1MEN1KMT2A
SCHEMBL18702002 0.78 EPHX2 (0.35) EPHX2RIPK1MEN1KMT2A
SCHEMBL24621674 0.77 MEN1 (0.32) EPHX2RIPK1MEN1KMT2A
SCHEMBL21577564 0.77 RIPK1 (0.32) EPHX2RIPK1MEN1KMT2A
SCHEMBL18701918 0.77 MEN1 (0.32) RIPK1MEN1KMT2A
SCHEMBL12208870 0.75 EPHX2 (0.33) EPHX2RIPK1MEN1KMT2A
SCHEMBL17886961 0.73 MEN1 (0.34) EPHX2RIPK1MEN1KMT2A
SCHEMBL21137552 0.72 HSD11B1 (0.41) EPHX2RIPK1

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-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same Frequency Therapeutics, Inc. (US) 2021-07-20 US disclosed
US-20200113913-A1 METHODS FOR HAIR FOLLICLE STEM CELL PROLIFERATION Frequency Therapeutics, Inc. 2020-04-16 US disclosed
US-20190352313-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS Frequency Therapeutics, Inc. 2019-11-21 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-20200113913-A1 METHODS FOR HAIR FOLLICLE STEM CELL PROLIFERATION SHH, WNT3A, WNT1 EPHX2 1940/4885RIPK1 1824/4885MEN1 4799/4885
US-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same MKI67, PROX1, DCX EPHX2 1675/4885RIPK1 2505/4885MEN1 3191/4885
US-20190352313-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS MCL1, PROX1, MKI67 EPHX2 2483/4885RIPK1 2083/4885MEN1 3908/4885

“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.