SCHEMBL4727722

SCHEMBL4727722

[CH2]c1ccc(P(=O)(O)O)[nH]1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.32
▸ CA4 P22748 1/20 0.32
▸ CA5A P35218 1/20 0.32
▸ CYTH3 O43739 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ EPN1 Q9Y6I3 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ TSHR P16473 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
SCHEMBL4727723 0.71 HMBS (0.46) CA2CA4CA5ACYTH3BTK
SCHEMBL3247756 0.62 CA2 (0.55) CA2CA4CA5ALMNATSHR
SCHEMBL2171752 0.60 CA2 (0.71) CA2CA4CA5ALMNATSHR
SCHEMBL4416358 0.59 — —
SCHEMBL20379757 0.55 CA2 (0.39) CA2CA4CA5A
SCHEMBL21625823 0.55 CYP1A2 (0.50) CA2CA4CA5ATSHR
SCHEMBL22999982 0.55 CA2 (0.60) CA2CA4CA5ALMNATSHR
SCHEMBL4953765 0.55 CA2 (0.60) CA2CA4CA5ALMNATSHR
SCHEMBL3482003 0.55 CA2 (0.39) CA2CA4CA5ALMNATSHR
SCHEMBL23000057 0.53 CA2 (0.50) CA2CA4CA5ATSHR

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-2008031888-A2 CONDENSED PYRIMIDINONES ACTIVE ON GLUTAMATERGIC RECEPTORS CAMPIANI GIUSEPPE (IT) 2008-03-20 — — WO claimed
WO-2008031888-A2 CONDENSED PYRIMIDINONES ACTIVE ON GLUTAMATERGIC RECEPTORS CAMPIANI GIUSEPPE (IT) 2008-03-20 — — WO disclosed
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