SCHEMBL30202159

SCHEMBL30202159

Cn1cc(-c2ccccc2)nc1C#Cc1nc(N2CC3(COC3)C2)c2cnn(C)c2n1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 9/20 0.37
BCDIN3D Q7Z5W3 3/20 0.33
SYK P43405 2/20 0.31
TTK P33981 1/20 0.31
ATAD2 Q6PL18 1/20 0.31
MAOB P27338 1/20 0.30
HTR6 P50406 1/20 0.30
EIF2AK2 P19525 1/20 0.30
MAP3K12 Q12852 1/20 0.30
HRH1 P35367 1/20 0.30
HRH4 Q9H3N8 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
SCHEMBL30202254 0.87 PIK3CA (0.40)
SCHEMBL24955834 0.86 MEN1 (0.43) PDE10AEIF2AK2
SCHEMBL24955832 0.85 PDE10A (0.32) PDE10A
SCHEMBL30202075 0.84 PDE10A (0.37) PDE10ABCDIN3DATAD2EIF2AK2HRH1
SCHEMBL30203054 0.83 CNR2 (0.38) PDE10ASYKMAP3K12
SCHEMBL24956758 0.81 PDE10A (0.38) PDE10ABCDIN3DATAD2EIF2AK2HRH1
SCHEMBL31106986 0.78 PDE10A (0.43) PDE10ABCDIN3DATAD2
SCHEMBL30202238 0.77 HRH1 (0.37) PDE10ABCDIN3DTTKEIF2AK2MAP3K12
SCHEMBL30202160 0.76 SYK (0.35) PDE10ASYKTTKMAP3K12
SCHEMBL24956778 0.75 HRH1 (0.38) PDE10ABCDIN3DEIF2AK2MAP3K12HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4377313-A1 IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE BenevolentAI Cambridge Limited (GB) 2024-06-05 EP claimed
WO-2023007185-A1 IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE Benevolentai Cambridge Limited (GB) 2023-02-02 WO claimed
US-20240343729-A1 IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE Benevolentai Cambridge Limited (GB) 2024-10-17 US disclosed
EP-4377313-A1 IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE BenevolentAI Cambridge Limited (GB) 2024-06-05 EP disclosed
WO-2023007185-A1 IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE Benevolentai Cambridge Limited (GB) 2023-02-02 WO 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-20240343729-A1 IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE SI, SLC10A2, NOS3 PDE10A 733/4885BCDIN3D 2678/4885SYK 260/4885

“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.