SCHEMBL8153189

SCHEMBL8153189

CC1CCCCC1C(C(N)O)P(=O)(S)S

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
EPHX1 P07099 1/20 0.32
ANPEP P15144 2/20 0.30
ERAP2 Q6P179 2/20 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
SCHEMBL8642189 0.85
SCHEMBL8640862 0.81 ANPEP (0.34) CA1CA2CA4ANPEPERAP2
SCHEMBL8153328 0.79 GRIN2D (0.31) CA1CA2CA4
SCHEMBL8637949 0.76 EPHX1 (0.38) CA1CA2EPHX1ANPEPERAP2
SCHEMBL8140777 0.74 EPHX1 (0.38) CA1CA2EPHX1ANPEPERAP2
SCHEMBL8149285 0.74 EPHX1 (0.38) CA1CA2EPHX1ANPEPERAP2
SCHEMBL8152956 0.70
SCHEMBL8155040 0.68 GRIN2D (0.33) ANPEPERAP2
SCHEMBL8645781 0.67 ANPEP (0.37) CA1CA2EPHX1ANPEPERAP2
SCHEMBL17751226 0.66 CA1 (0.50) CA1CA2CA4EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000013690-A1 EXOCYCLIC-PHOSPHOETHANOLAMINES CLARION PHARMACEUTICALS, INC. (US) 2000-03-16 WO claimed
US-5804569-A ANTIINFLAMMATORY, ANTIARRHYMIC AND LOCAL ANESTHETIC AGENT CLARION PHARMACEUTICALS INC. (US) 1998-09-08 US claimed
WO-2000013690-A1 EXOCYCLIC-PHOSPHOETHANOLAMINES CLARION PHARMACEUTICALS, INC. (US) 2000-03-16 WO disclosed
US-5804569-A ANTIINFLAMMATORY, ANTIARRHYMIC AND LOCAL ANESTHETIC AGENT CLARION PHARMACEUTICALS INC. (US) 1998-09-08 US disclosed