SCHEMBL21453769

SCHEMBL21453769

CCc1cnc(C2CCOCC2)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE1B Q01064 4/20 0.34
PDE1A P54750 4/20 0.34
PDE1C Q14123 4/20 0.34
CSF1R P07333 1/20 0.33
MAPK1 P28482 1/20 0.33
TMIGD3 P0DMS9 1/20 0.32
ADORA1 P30542 1/20 0.32
PDE9A O76083 1/20 0.30
DAO P14920 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
SCHEMBL22803238 0.88 ADORA1 (0.36) TMIGD3ADORA1
SCHEMBL21435084 0.83 BRS3 (0.33) PDE1BCSF1RDAO
SCHEMBL21449326 0.83 MAPK1 (0.33) PDE1BCSF1RMAPK1
Hydrochloric Acid SCHEMBL21435225 0.81 CSF1R (0.33) PDE1BCSF1RMAPK1
SCHEMBL21453308 0.80 CSF1R (0.37) PDE1BCSF1RPDE9A
SCHEMBL17619231 0.77 MAPK1 (0.39) PDE1BPDE1APDE1CCSF1RMAPK1
SCHEMBL15893921 0.73 CASP3 (0.34) PDE1BPDE1APDE1CCSF1RMAPK1
SCHEMBL21435151 0.73 ALDH1A1 (0.36) CSF1RMAPK1PDE9A
SCHEMBL21051383 0.71 PDE4B (0.45) MAPK1
SCHEMBL19398933 0.71 PDE1B (0.35) PDE1BPDE1APDE1CMAPK1PDE9A

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-2019195846-A1 IMIDAZOPIPERAZINONE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-10-10 WO disclosed