SCHEMBL17211112

SCHEMBL17211112

Cc1nc(C2C[C@H]2c2cn3ccccc3n2)cc(-n2nc(C)nc2C)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 1.00

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
SCHEMBL17201955 1.00 PDE10A (1.00) PDE10A
SCHEMBL15724676 1.00 PDE10A (1.00) PDE10A
SCHEMBL19822950 1.00 PDE10A (1.00) PDE10A
SCHEMBL15724689 0.90 PDE10A (0.82) PDE10A
SCHEMBL17211854 0.86 PDE10A (1.00) PDE10A
SCHEMBL15717680 0.86 PDE10A (1.00) PDE10A
SCHEMBL15717679 0.86 PDE10A (1.00) PDE10A
SCHEMBL15718459 0.86 PDE10A (1.00) PDE10A
SCHEMBL15718458 0.86 PDE10A (1.00) PDE10A
SCHEMBL17211912 0.86 PDE10A (1.00) PDE10A

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
US-9359348-B2 Cyclopropyl imidazopyridine PDE10 inhibitors MERCK SHARP & DOHME CORP. (US) 2016-06-07 US disclosed
US-20150307488-A1 CYCLOPROPYL IMIDAZOPYRIDINE PDE10 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-29 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-20150307488-A1 CYCLOPROPYL IMIDAZOPYRIDINE PDE10 INHIBITORS PDE12, PDE10A, PDE4A PDE10A 2/4885

“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.