SCHEMBL23900320

SCHEMBL23900320

O=C(COc1nc(=O)[nH]c(Cl)c1F)NC12CC3CCC1CCC(C3)C2

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.30
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
P2RY12 Q9H244 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
SCHEMBL23900367 0.84 PDE3B (0.42) PDE2APDE3BPDE3AP2RY12
SCHEMBL23900364 0.81 ALDH1A1 (0.31)
SCHEMBL23900508 0.79 PDE2A (0.33) PDE2APDE3BPDE3AP2RY12
SCHEMBL25138556 0.76 LMNA (0.33)
SCHEMBL23900293 0.72 PTPRC (0.33) PDE2APDE3BPDE3AP2RY12
SCHEMBL23900295 0.72 PDE3B (0.34) PDE2APDE3BPDE3AP2RY12
SCHEMBL23900313 0.72 ALDH1A1 (0.46) PDE2APDE3BPDE3AP2RY12
SCHEMBL23900437 0.71 ALDH1A1 (0.41) PDE2APDE3BPDE3AP2RY12
SCHEMBL23884349 0.70 ALDH1A1 (0.42) PDE2APDE3BPDE3AP2RY12
SCHEMBL23884290 0.69 PDE3B (0.42) PDE2APDE3BPDE3AP2RY12

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-2021203048-A1 NOVEL 2-PYRIMIDONE ANALOGS AS POTENT ANTIVIRAL AGENTS AGAINST ALPHAVIRUSES SOUTHERN RESEARCH INSTITUTE (US) 2021-10-07 WO disclosed