SCHEMBL21370122

SCHEMBL21370122

CNc1ncc(CN2CC(Cc3ncc(F)cn3)CC2C)s1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OGA O60502 18/20 0.38
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.30
OPRK1 P41145 1/20 0.30

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
SCHEMBL21370042 0.90 OGA (0.37) OGALMNAOPRK1
SCHEMBL21369594 0.90 OGA (0.37) OGALMNAOPRK1
SCHEMBL21370278 0.87 OGA (0.53) OGAOPRK1
SCHEMBL22964756 0.87 OGA (0.53) OGAOPRK1
SCHEMBL21359550 0.87 OGA (0.53) OGAOPRK1
SCHEMBL21359528 0.87 OGA (0.53) OGAOPRK1
SCHEMBL21370039 0.87 OGA (0.53) OGAOPRK1
SCHEMBL21370047 0.86 OGA (0.33) OGALMNA
SCHEMBL22078755 0.84 LMNA (0.37) OGALMNAGAAOPRK1
SCHEMBL21369622 0.83 OGA (0.35) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019178191-A1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS BIOGEN MA INC. (US) 2019-09-19 WO disclosed