SCHEMBL9150604

SCHEMBL9150604

CCOOP(O)(=S)OCC

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.33
LPAR2 Q9HBW0 3/20 0.32
LPAR3 Q9UBY5 3/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL11183163 0.87 LPAR2 (0.31) LPAR2LPAR3
Hydrochloric Acid SCHEMBL11503744 0.84 LPAR2 (0.30) LPAR2LPAR3
O,O-Diethyl S-Hydrogen Phosphorothioate SCHEMBL600183 0.81
SCHEMBL28016343 0.80
O,O-Diethyl S-Hydrogen Phosphorothioate SCHEMBL4585075 0.78 PPARD (0.39) PPARDLPAR2LPAR3TSHRALDH1A1
O,O-Diethyl S-Hydrogen Phosphorothioate SCHEMBL1502086 0.78 PPARD (0.39) PPARDLPAR2LPAR3TSHRALDH1A1
O,O-Diethyl S-Hydrogen Phosphorothioate SCHEMBL8429419 0.78 PPARD (0.39) PPARDLPAR2LPAR3TSHRALDH1A1
SCHEMBL27776127 0.78
SCHEMBL8445228 0.78 LPAR3 (0.55) LPAR2LPAR3
SCHEMBL11621885 0.76 TSHR (0.40) PPARDLPAR2LPAR3TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468477-B1 Process for producing dihydric phenols DAINIPPON INK & CHEMICALS (JP) 1995-01-11 EP claimed
US-5138104-A Reacting a phenol with a ketone peroxide in the presence of compound with at least one phosphorus-sulfur bond DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-08-11 US claimed
EP-0468477-A1 Process for producing dihydric phenols DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-01-29 EP claimed
EP-0468477-B1 Process for producing dihydric phenols DAINIPPON INK & CHEMICALS (JP) 1995-01-11 EP disclosed
US-5138104-A Reacting a phenol with a ketone peroxide in the presence of compound with at least one phosphorus-sulfur bond DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-08-11 US disclosed
EP-0468477-A1 Process for producing dihydric phenols DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-01-29 EP disclosed