SCHEMBL20833769

SCHEMBL20833769

CCOC(=O)C(=O)C(C1CC1)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
MAPT P10636 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 2/20 0.34
CYP2C9 P11712 1/20 0.34
NPSR1 Q6W5P4 1/20 0.32
GLO1 Q04760 1/20 0.32
ALDH1A1 P00352 5/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
EGLN1 Q9GZT9 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
SCHEMBL29597879 0.76 MAPT (0.39) MAPTL3MBTL1GAANPSR1GLO1
SCHEMBL114596 0.74 MAPT (0.38) MAPTL3MBTL1GAANPSR1GLO1
SCHEMBL24087504 0.70 CHRNB2 (0.35) CHRNB2CHRNB4CHRNA3CHRNA4L3MBTL1
SCHEMBL24229886 0.70 ALDH1A1 (0.42) MAPTL3MBTL1GAACYP2C9ALDH1A1
SCHEMBL4575008 0.69 ALDH1A1 (0.40) MAPTL3MBTL1GAANPSR1ALDH1A1
SCHEMBL6336675 0.68 ALDH1A1 (0.36) MAPTL3MBTL1GAANPSR1GLO1
SCHEMBL1514126 0.68 ALOX5 (0.40) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL2090558 0.68 ALOX5 (0.40) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL11354246 0.66
SCHEMBL9209640 0.66 L3MBTL1 (0.61) L3MBTL1GAANPSR1ALDH1A1TSHR

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-11753410-B2 Hormone receptor modulators for treating metabolic mutagenic and fibrotic conditions and disorders ARDELYX, INC. (US) 2023-09-12 US disclosed
US-20210380585-A1 HORMONE RECEPTOR MODULATORS FOR TREATING METABOLIC MUTAGENIC AND FIBROTIC CONDITIONS AND DISORDERS ARDELYX, INC. (US) 2021-12-09 US disclosed
WO-2019055808-A1 HORMONE RECEPTOR MODULATORS FOR TREATING METABOLIC MUTAGENIC AND FIBROTIC CONDITIONS AND DISORDERS ARDELYX, INC. (US) 2019-03-21 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-20210380585-A1 HORMONE RECEPTOR MODULATORS FOR TREATING METABOLIC MUTAGENIC AND FIBROTIC CONDITIONS AND DISORDERS NR1H4, FXR1, FXR2 CHRNB2 3155/4885CHRNB4 2423/4885CHRNA3 2039/4885
US-11753410-B2 Hormone receptor modulators for treating metabolic mutagenic and fibrotic conditions and disorders NR1H4, FXR1, FXR2 CHRNB2 3155/4885CHRNB4 2423/4885CHRNA3 2039/4885

“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.