SCHEMBL21369461

SCHEMBL21369461

CNc1ncc(CN2CCCCC2)s1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.64
LMNA P02545 1/20 0.47
OGA O60502 14/20 0.46
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.42

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
SCHEMBL21370127 0.98 SMN1; SMN2 (0.62) SMN1; SMN2LMNAOGAALDH1A1HTT
SCHEMBL22079257 0.86 SMN1; SMN2 (0.51) SMN1; SMN2LMNAOGAALDH1A1HTT
SCHEMBL22079383 0.86 SMN1; SMN2 (0.49) SMN1; SMN2LMNAOGAALDH1A1HTT
SCHEMBL22079715 0.84 SMN1; SMN2 (0.48) SMN1; SMN2LMNAOGAALDH1A1HTT
SCHEMBL21370130 0.83 ALDH1A1 (0.67) SMN1; SMN2LMNAOGAALDH1A1HTT
SCHEMBL16113448 0.81 SMN1; SMN2 (0.76) SMN1; SMN2OGA
SCHEMBL22078765 0.81 SMN1; SMN2 (0.68) SMN1; SMN2OGA
SCHEMBL20281964 0.79 SMN1; SMN2 (0.74) SMN1; SMN2OGA
SCHEMBL16113454 0.79 SMN1; SMN2 (1.00) SMN1; SMN2OGAHTT
SCHEMBL22697065 0.79 OGA (0.49) OGA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4327814-A2 MORPHOLINYL, PIPERAZINYL, OXAZEPANYL AND DIAZEPANYL O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS Biogen MA Inc. (US) 2024-02-28 EP disclosed
EP-3891146-B1 MORPHOLINYL, PIPERAZINYL, OXAZEPANYL AND DIAZEPANYL DERIVATIVES USEFUL AS O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS BIOGEN MA INC (US) 2023-09-27 EP disclosed
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-2020117961-A1 MORPHOLINYL, PIPERAZINYL, OXAZEPANYL AND DIAZEPANYL O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS BIOGEN MA INC. (US) 2020-06-11 WO disclosed
WO-2019178191-A1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS BIOGEN MA INC. (US) 2019-09-19 WO disclosed