SCHEMBL9566819

SCHEMBL9566819

O=C(NCCCO)Oc1ccnc(CO)c1

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL9566847 0.92 SMN1; SMN2 (0.48) SMN1; SMN2
SCHEMBL9566743 0.87 ALDH1A1 (0.44)
SCHEMBL9566774 0.87 SMN1; SMN2 (0.39) SMN1; SMN2
SCHEMBL9566810 0.84 LOXL2 (0.41) SMN1; SMN2
SCHEMBL8782221 0.80 SMN1; SMN2 (0.37) SMN1; SMN2
SCHEMBL9572913 0.77 ALDH1A1 (0.43) SMN1; SMN2
SCHEMBL9566818 0.76 ALDH1A1 (0.44)
SCHEMBL9566767 0.76 NOS3 (0.38)
Hydrochloric Acid SCHEMBL9566744 0.76 ALDH1A1 (0.43) SMN1; SMN2
SCHEMBL9519673 0.75 NOS3 (0.41)

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-0533130-A1 2-Hydroxymethylpyridines, the corresponding pyridine-N-oxides and derivatives thereof, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-24 EP disclosed