SCHEMBL5260871

SCHEMBL5260871

C=CCON=C1CN(C(=O)O)Cc2c1cnn2C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31

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
SCHEMBL5260866 1.00 CHRM2 (0.31) CHRM2CHRM1
SCHEMBL5187314 0.88 ELANE (0.36)
SCHEMBL4693156 0.83 MEN1 (0.38)
SCHEMBL4693154 0.83 MEN1 (0.38)
SCHEMBL4695166 0.79 NPBWR1 (0.36)
SCHEMBL4695168 0.79 NPBWR1 (0.36)
SCHEMBL5252364 0.76
SCHEMBL4134352 0.74 LMNA (0.43)
SCHEMBL4134354 0.74 LMNA (0.43)
SCHEMBL5187174 0.74 CYP19A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1399444-B1 NOVEL HETEROCYCLIC COMPOUNDS, METHOD FOR PREPARING SAME AND USE THEREOF AS MEDICINES, IN PARTICULAR AS ANTI-BACTERIAL AGENTS NOVEXEL (FR) 2007-04-11 EP disclosed