SCHEMBL2909365

SCHEMBL2909365

COc1ccc(CCN2C(=O)N(CC(C)C)C(=O)C23CCN(Cc2ccccc2CC(=O)O)CC3)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
MMP1 P03956 4/20 0.41
MMP9 P14780 4/20 0.41
MMP13 P45452 4/20 0.41
ADAM17 P78536 3/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
MCHR1 Q99705 2/20 0.40
CCR5 P51681 2/20 0.39
CCR3 P51677 1/20 0.38
OPRM1 P35372 3/20 0.38
OPRL1 P41146 3/20 0.38
DRD2 P14416 1/20 0.38
SIGMAR1 Q99720 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
SCHEMBL2942975 0.88 SIGMAR1 (0.48) MMP1MMP9MMP13ADAM17MEN1
SCHEMBL2913042 0.88 CCR8 (0.42) ALDH1A1MMP1MMP9MMP13ADAM17
SCHEMBL2449271 0.83 KDM4E (0.54) ALDH1A1MEN1POLBKMT2AMCHR1
SCHEMBL2915758 0.83 CCR8 (0.42) ALDH1A1MMP1MMP9MMP13ADAM17
SCHEMBL2915457 0.82 HSD17B10 (0.39) ALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL2909202 0.82 KCNA5 (0.36) ALDH1A1MMP1MMP9MMP13ADAM17
SCHEMBL2912440 0.81 HTR1A (0.41) ALDH1A1MMP1MMP9MMP13ADAM17
SCHEMBL2449927 0.81 CCR8 (0.52) ALDH1A1MEN1KMT2AMCHR1OPRM1
SCHEMBL2918586 0.81 MCHR1 (0.37) ALDH1A1MCHR1
SCHEMBL2915410 0.80 MEN1 (0.45) ALDH1A1MMP1MMP9MMP13ADAM17

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 10 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-A1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2008-10-15 EP claimed
WO-2007087448-A1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2007-08-02 WO claimed
EP-1979355-B1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2010-08-18 EP disclosed
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 ALDH1A1 736/4885MMP1 3112/4885MMP9 4212/4885

“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.