SCHEMBL21359581

SCHEMBL21359581

COc1ccc(C[C@@H]2CCCN(Cc3cnc(NC(C)=O)s3)C2)cc1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 18/20 0.71
▸ OPRK1 P41145 1/20 0.71
▸ SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL21370106 1.00 OGA (0.71) OGAOPRK1SMN1; SMN2
SCHEMBL21359533 0.94 OGA (0.63) OGAOPRK1
SCHEMBL21370256 0.94 OGA (0.63) OGAOPRK1
SCHEMBL21359477 0.90 OGA (0.70) OGAOPRK1
SCHEMBL21370250 0.90 OGA (0.70) OGAOPRK1
SCHEMBL21359483 0.89 OGA (0.64) OGAOPRK1SMN1; SMN2
SCHEMBL21359564 0.89 OGA (0.69) OGAOPRK1SMN1; SMN2
SCHEMBL21369538 0.89 OGA (0.69) OGAOPRK1SMN1; SMN2
SCHEMBL21369416 0.89 OGA (0.74) OGAOPRK1
SCHEMBL28583580 0.89 OGA (0.74) OGAOPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3765458-A1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS Biogen MA Inc. (US) 2021-01-20 — — EP disclosed
WO-2019178191-A1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS BIOGEN MA INC. (US) 2019-09-19 — — WO disclosed
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