SCHEMBL8353337

SCHEMBL8353337

CC#CCn1c(N2CCCC(N)C2)nc2cnn(Cc3ccc(OC)c4ccccc34)c(=O)c21

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.80
CHRM1 P11229 4/20 0.80

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
SCHEMBL5843040 0.91 DPP4 (0.72) DPP4CHRM1
SCHEMBL5843045 0.91 DPP4 (0.72) DPP4CHRM1
SCHEMBL4063246 0.90 DPP4 (0.82) DPP4CHRM1
SCHEMBL5842634 0.90 DPP4 (0.82) DPP4CHRM1
SCHEMBL5842621 0.90 DPP4 (0.82) DPP4CHRM1
SCHEMBL4063239 0.90 DPP4 (0.82) DPP4CHRM1
SCHEMBL4070626 0.89 DPP4 (1.00) DPP4CHRM1
Hydrochloric Acid SCHEMBL5843351 0.89 DPP4 (0.81) DPP4CHRM1
SCHEMBL4071726 0.89 DPP4 (1.00) DPP4CHRM1
Hydrochloric Acid SCHEMBL5842622 0.89 DPP4 (0.81) DPP4CHRM1

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
EP-1569936-B1 NOVEL SUBSTITUTED IMIDAZO-PYRIDINONES AND IMIDAZO-PYRIDAZEIONES, THE PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2009-03-18 EP disclosed
WO-2004050658-A1 NOVEL SUBSTITUTED IMIDAZO-PYRIDINONES AND IMIDAZO-PYRIDAZEIONES, THE PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-06-17 WO disclosed