SCHEMBL31662835

SCHEMBL31662835

CNc1cc(C#N)ccc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.52
EGLN2 Q96KS0 1/20 0.49
BACE1 P56817 5/20 0.48
IRAK4 Q9NWZ3 1/20 0.46
LMNA P02545 2/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
CSF1R P07333 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
SCHEMBL709010 0.84 GPR119 (0.55) GPR119EGLN2BACE1IRAK4LMNA
SCHEMBL532948 0.84 GPR119 (0.55) GPR119EGLN2IRAK4LMNAALDH1A1
SCHEMBL30062832 0.84 GPR119 (0.51) GPR119EGLN2BACE1IRAK4CCNC
SCHEMBL631353 0.83 GPR119 (0.54) GPR119EGLN2IRAK4LMNAALDH1A1
SCHEMBL356713 0.83 GPR119 (0.54) GPR119EGLN2BACE1IRAK4LMNA
SCHEMBL30062534 0.83 GPR119 (0.54) GPR119EGLN2IRAK4LMNAALDH1A1
SCHEMBL355131 0.83 GPR119 (0.68) GPR119EGLN2
SCHEMBL13156287 0.83 GPR119 (0.54) GPR119EGLN2IRAK4LMNAALDH1A1
SCHEMBL29378266 0.83 GPR119 (0.68) GPR119EGLN2
SCHEMBL30061047 0.83 GPR119 (0.49) GPR119EGLN2BACE1IRAK4CCNC

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-2025147756-A1 VIRAL SENSITIZERS COMPOSITIONS, METHODS AND USES THEREOF OTTAWA HOSPITAL RESEARCH INSTITUTE (CA) 2025-07-17 WO disclosed