SCHEMBL8154491

SCHEMBL8154491

CN(CCOP(O)(=S)S)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.36
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
FDPS P14324 1/20 0.33
FAAH O00519 1/20 0.33
PHGDH O43175 1/20 0.33
MGLL Q99685 1/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL8639035 1.00 ACHE (0.36) ACHEHRH4HRH3FDPSFAAH
SCHEMBL8154759 0.98 ACHE (0.34) ACHEHRH4HRH3FDPSFAAH
SCHEMBL8145618 0.85
SCHEMBL8141063 0.80 OPRM1 (0.34)
SCHEMBL14048919 0.80 FDPS (0.42) ACHEHRH4HRH3FDPSALDH1A1
SCHEMBL15780668 0.78 FDPS (0.39) ACHEHRH4HRH3FDPS
SCHEMBL8639383 0.78 OPRM1 (0.33)
SCHEMBL14048822 0.76 LPAR3 (0.37) ACHEFDPS
SCHEMBL8152912 0.74 GAA (0.31)
SCHEMBL8146799 0.74 GAA (0.31)

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-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