SCHEMBL30140908

SCHEMBL30140908

COc1nc(NC(=O)OC(C)(C)C)cnc1C#N

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.47
JAK3 P52333 1/20 0.39
BTK Q06187 1/20 0.39
ENPP1 P22413 1/20 0.39
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
AR P10275 1/20 0.39
GSK3B P49841 1/20 0.37
DYRK1A Q13627 1/20 0.37
CHEK1 O14757 3/20 0.37
MAP4K1 Q92918 5/20 0.36
ATR Q13535 1/20 0.36
EGLN2 Q96KS0 1/20 0.35
MAPKAPK2 P49137 2/20 0.35
KCNH2 Q12809 3/20 0.35
PLCG1 P19174 1/20 0.35

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
SCHEMBL14861758 1.00 SYK (0.47) SYKJAK3BTKENPP1MAPK8
SCHEMBL15142858 0.84 SYK (0.47) SYKJAK3BTKARGSK3B
SCHEMBL18185851 0.82 MAPK8 (0.43) SYKENPP1MAPK8MAPK9GSK3B
SCHEMBL22931760 0.81 SYK (0.51) SYKJAK3BTKARGSK3B
SCHEMBL14861638 0.77 PDCD1 (0.41) SYKGSK3BDYRK1AATRMAPKAPK2
SCHEMBL30140938 0.77 PDCD1 (0.41) SYKGSK3BDYRK1AATRMAPKAPK2
SCHEMBL19002319 0.76 GSK3B (0.39) SYKGSK3BDYRK1AATRMAPKAPK2
SCHEMBL20106531 0.74 CHEK1 (0.40) MAPK8MAPK9CHEK1MAP4K1KCNH2
SCHEMBL31709542 0.71 SYK (0.38) SYKGSK3BDYRK1AATREGLN2
SCHEMBL22931761 0.71 FLT3 (0.39) SYKARCHEK1

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
US-11472810-B2 Imidazopyrazinones as PDE1 inhibitors H. LUNDBECK A/S (DK) 2022-10-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11472810-B2 Imidazopyrazinones as PDE1 inhibitors PDE12, PDE4A, PDE5A SYK 3853/4885JAK3 942/4885BTK 2758/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.