SCHEMBL9985000

SCHEMBL9985000

O=C(O)NC1CC(Oc2nc(Cl)ccc2Br)C1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.34
PIK3CD O00329 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
SLC6A12 P48065 1/20 0.31
SSTR4 P31391 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
SCHEMBL9985003 1.00 PDE10A (0.34) PDE10APIK3CDL3MBTL1SLC6A12SSTR4
SCHEMBL7706040 0.84 PIK3CD (0.44) PIK3CDL3MBTL1
SCHEMBL2634656 0.81 PIK3CD (0.35) PDE10APIK3CD
SCHEMBL2634068 0.77 PDE10A (0.39) PDE10ASSTR4
SCHEMBL9985480 0.77 PDE10A (0.39) PDE10ASSTR4
SCHEMBL23089695 0.76 EGFR (0.33) PIK3CDL3MBTL1
SCHEMBL30537708 0.76 CHRNA3 (0.41) L3MBTL1
SCHEMBL9985754 0.75 PDE10A (0.60) PDE10APIK3CD
SCHEMBL9985759 0.75 PDE10A (0.60) PDE10APIK3CD
SCHEMBL9985833 0.72 PDE10A (0.37) PDE10APIK3CD

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-20160280703-A1 Heteroaryloxycarbocyclyl Compounds as PDE 10 Inhibitors AMGEN INC. 2016-09-29 US disclosed
US-8952037-B2 Heteroaryloxycarbocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2015-02-10 US disclosed
US-20110306591-A1 HETEROARYLOXYCARBOCYCLYL COMPOUNDS AS PDE10 INHIBITORS INC., AMGEN 2011-12-15 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 (2 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-20110306591-A1 HETEROARYLOXYCARBOCYCLYL COMPOUNDS AS PDE10 INHIBITORS PDE10A, PDE9A, HDAC10 PDE10A 1/4885PIK3CD 93/4885L3MBTL1 3881/4885
US-20160280703-A1 Heteroaryloxycarbocyclyl Compounds as PDE 10 Inhibitors PDE10A, PDE9A, PDE7A PDE10A 1/4885PIK3CD 79/4885L3MBTL1 3929/4885

“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.