SCHEMBL2590004

SCHEMBL2590004

CC(C)(C)OC(=O)N1CCC(c2nc3cc(C#N)ccc3[nH]2)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.50
HPGDS O60760 2/20 0.47
CETP P11597 1/20 0.46
PDE4B Q07343 1/20 0.43
IRAK4 Q9NWZ3 1/20 0.43
USP30 Q70CQ3 1/20 0.43
ALK Q9UM73 1/20 0.43
CHEK2 O96017 1/20 0.41
FASN P49327 1/20 0.41

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
SCHEMBL2595515 0.94 GPR119 (0.54) GPR119HPGDSCETPIRAK4ALK
SCHEMBL2596279 0.92 GPR119 (0.46) GPR119CETPIRAK4USP30ALK
SCHEMBL2595486 0.85 USP30 (0.48) USP30FASN
SCHEMBL12026595 0.83 HPGDS (0.47) HPGDSPDE4BCHEK2
SCHEMBL19400804 0.83 HPGDS (0.58) HPGDSUSP30
SCHEMBL2595535 0.80 HTR2B (0.48) USP30FASN
SCHEMBL17109171 0.80 USP2 (0.49) GPR119HPGDS
SCHEMBL19385385 0.79 HPGDS (0.48) HPGDSPDE4BUSP30CHEK2
SCHEMBL12026566 0.79 MAPT (0.47) HPGDSUSP30CHEK2
SCHEMBL1299150 0.79 SMN1; SMN2 (0.52) HPGDS

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
US-8946230-B2 Aryl- and heteroaryl- nitrogen-heterocyclic compounds as PDE10 inhibitors AMGEN INC. (US) 2015-02-03 US disclosed
EP-2569299-A1 NITROGEN- HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2013-03-20 EP disclosed
US-20110306590-A1 ARYL- AND HETEROARYL- NITROGEN-HETEROCYCLIC COMPOUNDS AS PDE10 INHIBITORS AMGEN INC. 2011-12-15 US disclosed
WO-2011143129-A1 NITROGEN- HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2011-11-17 WO disclosed
WO-2011143129-A1 NITROGEN- HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2011-11-17 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-20110306590-A1 ARYL- AND HETEROARYL- NITROGEN-HETEROCYCLIC COMPOUNDS AS PDE10 INHIBITORS HDAC10, PDE10A, PDE9A GPR119 16/4885HPGDS 2301/4885CETP 4563/4885

“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.