SCHEMBL20156664

SCHEMBL20156664

COc1nc(C)nc2[nH]nc(C=O)c12

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 6/20 0.38
▸ PIM1 P11309 2/20 0.35
▸ DYRK2 Q92630 2/20 0.35
▸ DYRK1B Q9Y463 2/20 0.35
▸ CDK9 P50750 1/20 0.33
▸ LRRK2 Q5S007 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
SCHEMBL18282729 0.72 DYRK1A (0.41) DYRK1APIM1DYRK2DYRK1BCDK9
SCHEMBL22423043 0.71 DYRK1A (0.40) DYRK1APIM1DYRK2DYRK1BCDK9
SCHEMBL22423037 0.67 MAPK1 (0.38) —
SCHEMBL6342720 0.67 PKM (0.34) DYRK1A
SCHEMBL18291808 0.65 DYRK1A (0.33) DYRK1APIM1DYRK2DYRK1BCDK9
SCHEMBL18282757 0.64 DYRK1A (0.33) DYRK1APIM1DYRK2DYRK1B
SCHEMBL18281321 0.62 DYRK1A (0.38) DYRK1APIM1DYRK2DYRK1B
SCHEMBL18291865 0.62 DYRK1A (0.32) DYRK1A
SCHEMBL31582903 0.60 LMNA (0.38) —
SCHEMBL19494135 0.58 MAPK1 (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3302484-B1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME (US) 2020-09-16 — — EP disclosed
US-20180134712-A1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-05-17 — — 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-20180134712-A1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS PDE12, PDE2A, PDE4D DYRK1A 831/4885PIM1 2309/4885DYRK2 314/4885

“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.

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