SCHEMBL18291865

SCHEMBL18291865

COc1nc(C)nc2[nH]nc(CCC(C)(C)[Si](C)(C)O)c12

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 2/20 0.32

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
SCHEMBL18282757 0.74 DYRK1A (0.33) DYRK1A
SCHEMBL22423043 0.62 DYRK1A (0.40) DYRK1A
SCHEMBL20156664 0.62 DYRK1A (0.38) DYRK1A
SCHEMBL18290651 0.60 — —
Hydrochloric Acid SCHEMBL20603213 0.58 LRRK2 (0.30) —
SCHEMBL19011285 0.56 NUDT1 (0.33) —
SCHEMBL14621843 0.55 TLR8 (0.34) —
SCHEMBL14391336 0.55 — —
SCHEMBL10265707 0.55 CALM1 (0.40) —
SCHEMBL15214380 0.55 ALDH1A1 (0.33) —

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