SCHEMBL5258305

SCHEMBL5258305

C=CCO/N=C1\CN(C(=O)O)Cc2occc21

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
PKM P14618 1/20 0.36
CHRM2 P08172 1/20 0.32
CHRM1 P11229 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
SCHEMBL5258311 1.00 MAPT (0.36) MAPTPKMCHRM2CHRM1
SCHEMBL5187183 0.85 HDAC1 (0.33) MAPTPKM
SCHEMBL5187181 0.85 HDAC1 (0.33) MAPTPKM
SCHEMBL5257624 0.77 CHRM2 (0.33) CHRM2CHRM1
SCHEMBL5257617 0.77 CHRM2 (0.33) CHRM2CHRM1
SCHEMBL5260866 0.72 CHRM2 (0.31) CHRM2CHRM1
SCHEMBL5260871 0.72 CHRM2 (0.31) CHRM2CHRM1
SCHEMBL5256713 0.72 CHRM2 (0.31) CHRM2CHRM1
SCHEMBL5256711 0.72 CHRM2 (0.31) CHRM2CHRM1
SCHEMBL5187023 0.72 CYP19A1 (0.33)

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-1798231-A2 Intermediate products for the preparation of antibacterial compounds NOVEXEL (FR) 2007-06-20 EP disclosed