SCHEMBL22164266

SCHEMBL22164266

CC(C)(C)[Si](C)(C)OCc1cc(N2CCC2)nc2cc([C@@H]3CCCCN3C(=O)O)nn12

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.33

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
SCHEMBL2738201 0.92 ALDH1A1 (0.35) —
SCHEMBL22164343 0.83 KDM4E (0.33) —
SCHEMBL15957809 0.81 HCRTR1 (0.32) —
SCHEMBL30311372 0.79 DPP4 (0.33) —
SCHEMBL22164346 0.79 ALDH1A1 (0.34) —
SCHEMBL22175842 0.79 GPR119 (0.36) PDE10A
SCHEMBL30311324 0.79 GPR119 (0.36) PDE10A
SCHEMBL30311192 0.78 NR1H2 (0.33) —
SCHEMBL2738204 0.76 MAPT (0.33) —
SCHEMBL2737925 0.73 GPR119 (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020138015-A1 PYRAZOLO[1,5-A]PYRIMIDINE MACROCYCLIC COMPOUND 大正製薬株式会社 2020-07-02 — — WO disclosed
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