SCHEMBL5557033

SCHEMBL5557033

Cc1nc2c3c(ccn2c1C)C(=O)[C@H]([Si](C)(C)C(C)(C)C)[C@@H](c1ccccc1)O3

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 3/20 0.34
ATP4B P51164 3/20 0.34
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 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
SCHEMBL1815255 0.82 RET (0.36) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL4731101 0.82 RET (0.36) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL4733704 0.79 L3MBTL1 (0.36) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL5557163 0.78 ATP4A (0.35) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL6487366 0.78 ATP4A (0.35) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL4981356 0.77 ATP4A (0.35) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL5652760 0.76 ATP4A (0.32) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL5032825 0.74 CYP19A1 (0.50) ATP4AATP4B
SCHEMBL4985180 0.70 ATP4A (0.36) ATP4AATP4BCYP3A4CYP2C9
SCHEMBL4591277 0.70 ATP4A (0.36) ATP4AATP4BCYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1286999-B1 PYRANO[2,3-c]IMIDAZO[1,2-a]PYRIDINE DERIVATIVES FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS NYCOMED GMBH (DE) 2007-12-19 EP disclosed
US-6936623-B2 Pyrano[2,3-C]imidazo[-1,2-A]pyridine derivatives for the treatment of gastrointestinal disorders ALTANA PHARMA AG (DE) 2005-08-30 US disclosed
US-20040180920-A1 Pyrano[2,3-C]imidazo[-1,2-A]pyridine derivatives for the treatment of gastrointestinal disorders ALTANA PHARMA AG (DE) 2004-09-16 US disclosed
US-20030100578-A1 Pyrano[2,3-c]imidazo[-1,2-a]pyridine derivatives for the treatment of gastrointestinal disorders ALTANA PHARMA AG (DE) 2003-05-29 US disclosed
EP-1286999-A1 PYRANO[2,3-c]IMIDAZO[1,2-a]PYRIDINE DERIVATIVES FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS ALTANA Pharma AG (DE) 2003-03-05 EP disclosed
WO-2001072755-A1 PYRANO[2,3-C]IMIDAZO[-1,2-A]PYRIDINE DERIVATIVES FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS ALTANA PHARMA AG (DE) 2001-10-04 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-20030100578-A1 Pyrano[2,3-c]imidazo[-1,2-a]pyridine derivatives for the treatment of gastrointestinal disorders ALPI, GIPR, SLC10A2 ATP4A 618/4885ATP4B 1962/4885CYP3A4 67/4885
US-20040180920-A1 Pyrano[2,3-C]imidazo[-1,2-A]pyridine derivatives for the treatment of gastrointestinal disorders ALPI, GIPR, SLC10A2 ATP4A 612/4885ATP4B 2007/4885CYP3A4 79/4885

“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.