SCHEMBL18291808

SCHEMBL18291808

CCCCOCc1n[nH]c2nc(C)nc(OC)c12

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 5/20 0.33
▸ PIM1 P11309 2/20 0.31
▸ DYRK2 Q92630 2/20 0.31
▸ DYRK1B Q9Y463 2/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ CDK9 P50750 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
SCHEMBL18290590 0.85 — —
SCHEMBL14006361 0.63 NPSR1 (0.34) —
SCHEMBL19199404 0.62 PDE4D (0.41) —
SCHEMBL19773320 0.58 P2RX7 (0.37) —
SCHEMBL5318087 0.54 HPGD (0.36) —
Methoxymethane SCHEMBL6557527 0.53 TSHR (0.63) —
Methoxymethane SCHEMBL6774591 0.53 TSHR (0.44) —
SCHEMBL8600029 0.52 TSHR (0.71) —
SCHEMBL15167 0.52 — —
SCHEMBL439119 0.52 TSHR (0.71) —

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
WO-2016191935-A1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-12-08 — — WO disclosed
WO-2016196071-A1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-12-08 — — WO disclosed
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