SCHEMBL21370127

SCHEMBL21370127

CNc1ncc(CN2CCCC2)s1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
LMNA P02545 1/20 0.49
ALDH1A1 P00352 2/20 0.45
OGA O60502 13/20 0.45
HTT P42858 1/20 0.43

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
SCHEMBL21369461 0.98 SMN1; SMN2 (0.64) SMN1; SMN2LMNAALDH1A1OGAHTT
SCHEMBL22079383 0.87 SMN1; SMN2 (0.49) SMN1; SMN2LMNAALDH1A1OGAHTT
SCHEMBL22079257 0.87 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1OGAHTT
SCHEMBL22079715 0.86 SMN1; SMN2 (0.48) SMN1; SMN2LMNAALDH1A1OGAHTT
SCHEMBL21370130 0.84 ALDH1A1 (0.67) SMN1; SMN2LMNAALDH1A1OGAHTT
SCHEMBL20281964 0.80 SMN1; SMN2 (0.74) SMN1; SMN2OGA
SCHEMBL22697065 0.80 OGA (0.49) OGA
SCHEMBL27100917 0.80 SMN1; SMN2 (0.46) SMN1; SMN2LMNAOGAHTT
SCHEMBL22433477 0.80 LMNA (0.46) SMN1; SMN2LMNAALDH1A1OGAHTT
SCHEMBL22078765 0.79 SMN1; SMN2 (0.68) SMN1; SMN2OGA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4186899-A1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS Biogen MA Inc. (US) 2023-05-31 EP disclosed
EP-3765458-B1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS BIOGEN MA INC (US) 2023-01-11 EP disclosed
WO-2019178191-A1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS BIOGEN MA INC. (US) 2019-09-19 WO disclosed