SCHEMBL4732548

SCHEMBL4732548

CC[C@]1(OC)c2ccn3c(Cl)c(C)nc3c2O[C@H](c2ccccc2)[C@H]1O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 1/20 0.34
ATP4B P51164 1/20 0.34

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
SCHEMBL4733625 1.00 ATP4A (0.34) ATP4AATP4B
SCHEMBL4733606 0.85 ATP4A (0.33) ATP4AATP4B
SCHEMBL4731002 0.85 ATP4A (0.33) ATP4AATP4B
SCHEMBL4736403 0.85 ATP4A (0.35) ATP4AATP4B
SCHEMBL4731111 0.82 ATP4A (0.35) ATP4AATP4B
SCHEMBL4735663 0.81 ATP4A (0.35) ATP4AATP4B
SCHEMBL4731626 0.81 ATP4A (0.35) ATP4AATP4B
SCHEMBL4734927 0.81 ATP4A (0.33) ATP4AATP4B
SCHEMBL4730499 0.78 ATP4A (0.33) ATP4AATP4B
SCHEMBL4737170 0.75 ATP4A (0.35) ATP4AATP4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008058990-A1 7,7-DISUBSTITUTED PYRANO-[2,3-C]-IMIDAZO-[1,2-A]-PYRIDINE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS NYCOMED GMBH (DE) 2008-05-22 WO claimed
WO-2008058990-A1 7,7-DISUBSTITUTED PYRANO-[2,3-C]-IMIDAZO-[1,2-A]-PYRIDINE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS NYCOMED GMBH (DE) 2008-05-22 WO disclosed