SCHEMBL2918586

SCHEMBL2918586

COc1ccc(CCN2C(=O)N(CC(C)C)C(=O)C23CCN(c2ccc(F)c(CC(=O)O)c2)CC3)cc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 2/20 0.35
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PTGDR Q13258 1/20 0.34
CYP3A4 P08684 2/20 0.33
HTR1A P08908 1/20 0.33
HTR7 P34969 1/20 0.33
HTR6 P50406 1/20 0.33

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
SCHEMBL2909202 0.92 KCNA5 (0.36) MAPTADRA1DADRA1AADRA1BALDH1A1
SCHEMBL2915457 0.92 HSD17B10 (0.39) MAPTADRA1DADRA1AADRA1BALDH1A1
SCHEMBL2917325 0.90 MAPT (0.37) L3MBTL1MAPTADRA1DADRA1AADRA1B
SCHEMBL2912440 0.87 HTR1A (0.41) MAPTADRA1DADRA1AADRA1BALDH1A1
SCHEMBL2914341 0.84 FFAR4 (0.39) MAPTADRA1DADRA1AADRA1BALDH1A1
SCHEMBL13850495 0.84 ADRA1D (0.37) L3MBTL1MAPTADRA1DADRA1AADRA1B
SCHEMBL2910436 0.83 PLA2G4A (0.41) MAPTALDH1A1HTR1AHTR7HTR6
SCHEMBL2916363 0.83 ITGB3 (0.41) MCHR1MAPTALDH1A1HTR1AHTR7
SCHEMBL2909050 0.82 PTGDR (0.44) PTGDR
SCHEMBL2916345 0.82 PTGDR (0.45) PTGDR

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
EP-1979355-B1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2010-08-18 EP claimed
US-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US claimed
EP-1979355-B1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2010-08-18 EP disclosed
US-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US disclosed
US-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US disclosed
US-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US disclosed
WO-2007087448-A1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2007-08-02 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 (1 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-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS PPARD, PPARG, PPARA MCHR1 4317/4885L3MBTL1 4532/4885MAPT 3926/4885

“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.