SCHEMBL30890501

SCHEMBL30890501

O=C(O)C1CC2(CN1)Oc1ccncc1NC2=O

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CCNC P24863 3/20 0.32
▸ CDK8 P49336 3/20 0.32
▸ HASPIN Q8TF76 3/20 0.32
▸ CDK19 Q9BWU1 2/20 0.32
▸ GRM2 Q14416 1/20 0.32
▸ GRM3 Q14832 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ BACE1 P56817 2/20 0.31

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
SCHEMBL27244751 0.89 CCNC (0.34) CCNCCDK8HASPINCDK19BACE1
SCHEMBL27245165 0.76 L3MBTL1 (0.35) GRM2GRM3CYP1A2ALOX15ALDH1A1
SCHEMBL27245180 0.73 GAA (0.35) GRM2GRM3CYP1A2ALOX15ALDH1A1
SCHEMBL27245043 0.72 BACE1 (0.39) ALDH1A1MAPTHSD17B10BACE1
Hydrochloric Acid SCHEMBL27245163 0.71 BACE1 (0.39) ALDH1A1MAPTHSD17B10BACE1
SCHEMBL27244874 0.70 IMPDH2 (0.35) CCNCCDK8HASPIN
SCHEMBL27245044 0.68 AKR1B1 (0.42) ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL30890769 0.68 AKR1B1 (0.41) ALDH1A1KDM4E
SCHEMBL1191378 0.66 KDM4E (0.44) CCNCCDK8HASPINCDK19ALDH1A1
SCHEMBL30890459 0.65 AAK1 (0.34) CCNCCDK8HASPIN

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-4612156-A1 ANTI-VIRAL COMPOUNDS Aligos Therapeutics, Inc. (US) 2025-09-10 — — EP disclosed
WO-2024097296-A1 ANTI-VIRAL COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2024-05-10 — — WO disclosed
Send feedback