SCHEMBL4154282

SCHEMBL4154282

c1ccc2nc(COc3ccc(-c4n[nH]cc4-c4ccncc4)nc3)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 10/20 0.55
LGALS3 P17931 1/20 0.54
PDE4D Q08499 1/20 0.54

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
SCHEMBL214481 0.88 PDE10A (0.67) PDE10ALGALS3PDE4D
SCHEMBL30819467 0.88 PDE10A (0.67) PDE10ALGALS3PDE4D
SCHEMBL4147718 0.88 PDE10A (0.54) PDE10ALGALS3PDE4D
SCHEMBL4156102 0.86 PDE10A (0.48) PDE10ALGALS3PDE4D
SCHEMBL4146631 0.83 PDE10A (0.51) PDE10ALGALS3PDE4D
SCHEMBL30123628 0.82 PDE10A (0.56) PDE10ALGALS3PDE4D
SCHEMBL3272329 0.82 PDE10A (0.56) PDE10ALGALS3PDE4D
SCHEMBL4165969 0.81 PDE10A (0.52) PDE10ALGALS3PDE4D
SCHEMBL4153869 0.81 PDE10A (0.79) PDE10ALGALS3PDE4D
SCHEMBL13772728 0.80 PDE10A (0.68) PDE10ALGALS3PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090176829-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER INC 2009-07-09 US claimed
WO-2007129183-A2 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER PRODUCTS INC. (US) 2007-11-15 WO claimed
US-20090176829-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER INC 2009-07-09 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-20090176829-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PDE12, PDE7A, PDE9A PDE10A 4/4885LGALS3 4543/4885PDE4D 17/4885

“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.