SCHEMBL5375836

SCHEMBL5375836

O[C@@H]1CCC[C@H](Oc2ccc(-c3ccccc3)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FURIN P09958 2/20 0.46
NAAA Q02083 1/20 0.45
EPHX2 P34913 1/20 0.42
SLC6A2 P23975 2/20 0.41
SLC6A3 Q01959 2/20 0.41
PARP10 Q53GL7 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC6A4 P31645 2/20 0.40
FFAR4 Q5NUL3 2/20 0.39
HRH1 P35367 2/20 0.39
CHEK2 O96017 1/20 0.39

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
SCHEMBL6575784 1.00 FURIN (0.46) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL5394014 1.00 FURIN (0.46) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL6575789 1.00 FURIN (0.46) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL5386182 1.00 FURIN (0.46) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL5383373 1.00 FURIN (0.46) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL5387056 1.00 FURIN (0.46) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL6573174 0.90 NAAA (0.47) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL5375025 0.90 NAAA (0.47) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL5375027 0.90 NAAA (0.47) FURINNAAAEPHX2SLC6A2SLC6A3
SCHEMBL5390747 0.90 NAAA (0.47) FURINNAAAEPHX2SLC6A2SLC6A3

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
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 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-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA FURIN 4617/4885NAAA 1727/4885EPHX2 1945/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA FURIN 4576/4885NAAA 1886/4885EPHX2 2045/4885

“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.