SCHEMBL9984647

SCHEMBL9984647

O=C(O)NC1CC(Oc2ncc(F)cc2Br)C1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
ABHD6 Q9BV23 1/20 0.35
SSTR4 P31391 3/20 0.34
PDE10A Q9Y233 4/20 0.34
IDO1 P14902 5/20 0.34
ACACB O00763 3/20 0.33
PIK3CD O00329 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4D Q08499 1/20 0.33
ABHD12 Q8N2K0 1/20 0.32
AR P10275 1/20 0.31

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
SCHEMBL9984652 1.00 CNR1 (0.35) CNR1CNR2ABHD6SSTR4PDE10A
SCHEMBL7694399 0.83 PIK3CD (0.45) SSTR4IDO1PIK3CD
SCHEMBL21492870 0.78 EPHX2 (0.33) ACACBPIK3CD
SCHEMBL2633869 0.78 PDE10A (0.58) PDE10A
SCHEMBL2633870 0.78 PDE10A (0.58) PDE10A
SCHEMBL9985480 0.76 PDE10A (0.39) CNR1CNR2SSTR4PDE10A
SCHEMBL2634068 0.76 PDE10A (0.39) CNR1CNR2SSTR4PDE10A
SCHEMBL24344050 0.76 ACACB (0.36) PDE10AACACB
SCHEMBL9984507 0.76 PDE10A (0.36) PDE10APIK3CD
SCHEMBL9984506 0.76 PDE10A (0.36) 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 CNR1 2711/4885CNR2 3196/4885ABHD6 347/4885
US-20160280703-A1 Heteroaryloxycarbocyclyl Compounds as PDE 10 Inhibitors PDE10A, PDE9A, PDE7A CNR1 2707/4885CNR2 3141/4885ABHD6 384/4885

“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.