SCHEMBL5375025

SCHEMBL5375025

OC1CCC(Oc2ccc(-c3ccccc3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.47
▸ CHEK2 O96017 1/20 0.45
▸ EPHX2 P34913 1/20 0.44
▸ SLC6A2 P23975 5/20 0.44
▸ SLC6A3 Q01959 4/20 0.44
▸ SLC6A4 P31645 5/20 0.42
▸ HRH1 P35367 1/20 0.41
▸ MMP3 P08254 1/20 0.40
▸ MAP4K4 O95819 1/20 0.38
▸ FURIN P09958 1/20 0.38

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
SCHEMBL5390747 1.00 NAAA (0.47) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5375027 1.00 NAAA (0.47) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL6573174 1.00 NAAA (0.47) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5394014 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5383373 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5386182 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL6575789 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5375836 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5387056 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL6575784 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3

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 5 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-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
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 — — EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 — — 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-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA NAAA 1727/4885CHEK2 3061/4885EPHX2 1945/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA NAAA 1886/4885CHEK2 3153/4885EPHX2 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.

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