SCHEMBL20833739

SCHEMBL20833739

Fc1cccc(Cl)c1-n1ncc(C2CC2)c1CCl

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.42
DHODH Q02127 1/20 0.36
HDAC9 Q9UKV0 1/20 0.35
MAPK14 Q16539 7/20 0.33
GRM2 Q14416 3/20 0.33
HTR1A P08908 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
OPRL1 P41146 4/20 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
SCHEMBL20833797 0.92 NR1H4 (0.40) NR1H4DHODHMAPK14GRM2SLC6A2
SCHEMBL17839932 0.91 NR1H4 (0.41) NR1H4MAPK14GRM2
SCHEMBL30807043 0.89 NR1H4 (0.41) NR1H4DHODHHDAC9MAPK14HTR1A
SCHEMBL20833740 0.89 NR1H4 (0.43) NR1H4DHODHHDAC9MAPK14HTR1A
SCHEMBL20833879 0.89 NR1H4 (0.41) NR1H4DHODHHDAC9MAPK14HTR1A
SCHEMBL30807047 0.85 NR1H4 (0.36) NR1H4DHODHGRM2OPRL1
SCHEMBL20833799 0.85 NR1H4 (0.36) NR1H4DHODHGRM2OPRL1
SCHEMBL19689540 0.80 NR1H4 (0.46) NR1H4MAPK14OPRL1
SCHEMBL20833733 0.79 NR1H4 (0.40) NR1H4MAPK14GRM2
SCHEMBL1097296 0.79 NR1H4 (0.40) NR1H4DHODHMAPK14GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111655680-B Hormone receptor modulators for the treatment of metabolic mutations and fibrotic conditions and disorders 阿德利克斯股份有限公司 2024-03-05 CN disclosed
US-11753410-B2 Hormone receptor modulators for treating metabolic mutagenic and fibrotic conditions and disorders ARDELYX, INC. (US) 2023-09-12 US disclosed
US-11753410-B2 Hormone receptor modulators for treating metabolic mutagenic and fibrotic conditions and disorders ARDELYX, INC. (US) 2023-09-12 US disclosed
US-11753410-B2 Hormone receptor modulators for treating metabolic mutagenic and fibrotic conditions and disorders ARDELYX, INC. (US) 2023-09-12 US disclosed
EP-3681881-B1 HORMONE RECEPTOR MODULATORS FOR TREATING METABOLIC MUTAGENIC AND FIBROTIC CONDITIONS AND DISORDERS ARDELYX INC (US) 2022-11-02 EP 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 NR1H4 1/4885DHODH 4137/4885HDAC9 2194/4885
US-11753410-B2 Hormone receptor modulators for treating metabolic mutagenic and fibrotic conditions and disorders NR1H4, FXR1, FXR2 NR1H4 1/4885DHODH 4137/4885HDAC9 2194/4885

“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.