SCHEMBL2374048

SCHEMBL2374048

Cc1oc(C2CC2)nc1CN

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.32
PPARA Q07869 5/20 0.32
PPARD Q03181 1/20 0.32
ACHE P22303 2/20 0.32
DGAT2 Q96PD7 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL15326810 0.82 GPR4 (0.34) PPARGPPARAPPARDACHEDGAT2
SCHEMBL16260514 0.81 PPARG (0.37) PPARGPPARAPPARDDGAT2
SCHEMBL5563195 0.81 PPARG (0.32) PPARGPPARAPPARDDGAT2KDM4E
SCHEMBL19022068 0.77 GPR4 (0.32) PPARGPPARAPPARDDGAT2KDM4E
SCHEMBL9096773 0.75 PPARG (0.34) PPARGPPARAPPARDDGAT2
SCHEMBL10810549 0.74 PPARG (0.40) PPARGPPARAPPARDDGAT2NPC1
SCHEMBL3822459 0.73 NPC1 (0.32) ACHEKDM4ENPC1ALDH1A1GAA
SCHEMBL5558839 0.73 PPARG (0.39) PPARGPPARAPPARDNPC1ALDH1A1
Hydrochloric Acid SCHEMBL3822153 0.72 NPC1 (0.31) ACHENPC1ALDH1A1RAB9A
SCHEMBL4474884 0.72 PPARG (0.43) PPARGPPARAPPARDDGAT2NPC1

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
EP-2552918-B1 N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS HOFFMANN LA ROCHE (CH) 2014-06-11 EP disclosed
US-8410117-B2 Imidazopyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 2013-04-02 US disclosed
EP-2552918-A1 N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS F. Hoffmann-La Roche AG (CH) 2013-02-06 EP disclosed
US-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. 2011-09-29 US disclosed
WO-2011117264-A1 N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-09-29 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-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES PDE5A, PDE3B, PDE3A PPARG 700/4885PPARA 1157/4885PPARD 242/4885

“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.