SCHEMBL823005

SCHEMBL823005

CCCP(=O)(CCO)CCO

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.40
GABBR2 O75899 2/20 0.36
GABBR1 Q9UBS5 2/20 0.36
GABRR1 P24046 1/20 0.36
LPAR3 Q9UBY5 3/20 0.35
LPAR2 Q9HBW0 1/20 0.35
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.31
GAA P10253 1/20 0.31
FDPS P14324 1/20 0.31
LMNA P02545 2/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL1085723 0.84 PPARD (0.41) PPARDALDH1A1GAATSHR
SCHEMBL563253 0.84 L3MBTL1 (0.48) L3MBTL1GABBR2GABBR1GABRR1LPAR3
SCHEMBL25355856 0.83 GABBR2 (0.48) PPARDGABBR2GABBR1GABRR1LPAR3
SCHEMBL3017433 0.83 ALDH1A1 (0.43) PPARDL3MBTL1GABBR2GABBR1GABRR1
SCHEMBL7553549 0.79 LPAR3 (0.56) LPAR3LPAR2ALDH1A1SMN1; SMN2TRPM8
SCHEMBL10933308 0.79 LPAR3 (0.56) LPAR3LPAR2ALDH1A1SMN1; SMN2TRPM8
SCHEMBL10934438 0.79 LPAR3 (0.56) LPAR3LPAR2ALDH1A1SMN1; SMN2TRPM8
SCHEMBL314144 0.79 LPAR3 (0.56) LPAR3LPAR2ALDH1A1SMN1; SMN2TRPM8
SCHEMBL10937369 0.79 LPAR3 (0.56) LPAR3LPAR2ALDH1A1SMN1; SMN2TRPM8
SCHEMBL4129407 0.79 L3MBTL1 (0.37) PPARDL3MBTL1GABBR2GABBR1GABRR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898738-B1 PROCESS TO PREPARE HALOGEN-FREE, FLAME-RETARDANT AQUEOUS POLYURETHANE DISPERSIONS STAHL INT B V (NL) 2023-08-23 EP disclosed
EP-3898738-A1 PROCESS TO PREPARE HALOGEN-FREE, FLAME-RETARDANT AQUEOUS POLYURETHANE DISPERSIONS Stahl International B.V. (NL) 2021-10-27 EP disclosed
WO-2020130831-A1 PROCESS TO PREPARE HALOGEN-FREE, FLAME-RETARDANT AQUEOUS POLYURETHANE DISPERSIONS STAHL INTERNATIONAL B.V. (NL) 2020-06-25 WO disclosed
US-8058322-B2 Flame-retardant flexible polyurethane foam ICL-IP AMERICA INC. (US) 2011-11-15 US disclosed
US-20090281205-A1 Flame-retardant flexible polyurethane foam ICL-IP AMERICA INC. 2009-11-12 US disclosed