SCHEMBL30202077

SCHEMBL30202077

Cn1cc(-c2ccccc2)nc1C#Cc1nc(N2C[C@H]3COC[C@H]3C2)c2cnn(C3COC3)c2n1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.35
PIK3CA P42336 14/20 0.35
MTOR P42345 14/20 0.35
PIK3CG P48736 3/20 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
SCHEMBL24956792 1.00 PDE10A (0.35) PDE10APIK3CAMTORPIK3CG
SCHEMBL30202075 0.91 PDE10A (0.37) PDE10APIK3CAMTOR
SCHEMBL24956793 0.87 MTOR (0.41) PDE10APIK3CAMTOR
SCHEMBL24956794 0.87 PDE10A (0.37) PDE10APIK3CAMTOR
SCHEMBL30202391 0.87 PDE10A (0.35) PDE10APIK3CAMTOR
SCHEMBL24955663 0.84 DGAT1 (0.37) PIK3CAMTORPIK3CG
SCHEMBL24956795 0.83 PIK3CA (0.48) PIK3CAMTORPIK3CG
SCHEMBL24956764 0.82 PIK3CA (0.37) PIK3CAMTORPIK3CG
SCHEMBL24955686 0.81 PDE10A (0.38) PDE10APIK3CA
SCHEMBL30202390 0.81 PDE10A (0.38) PDE10APIK3CA

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 733/4885PIK3CA 2011/4885MTOR 777/4885

“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.