SCHEMBL6561176

SCHEMBL6561176

CCCCCC(O)C1=CC=CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.35
DDAH1 O94760 1/20 0.35
GAPDH P04406 1/20 0.35
MAPT P10636 1/20 0.35
GPR84 Q9NQS5 3/20 0.34
SPHK1 Q9NYA1 1/20 0.34
FFAR1 O14842 1/20 0.34
ADRB2 P07550 4/20 0.34
PPARG P37231 2/20 0.34
TOP1 P11387 3/20 0.33
LMNA P02545 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL13696257 0.84 MAPT (0.33) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL6677627 0.82 OPRM1 (0.32) MAPTGPR84FFAR1LMNA
SCHEMBL6905191 0.82 DNM1 (0.33) LMNA
SCHEMBL6910830 0.81 OPRM1 (0.35) GPR84SPHK1
SCHEMBL6913100 0.81 NR1I2 (0.38)
SCHEMBL6911323 0.81 DNM1 (0.37) GPR84LMNACA2
SCHEMBL6907025 0.79 GPR84 (0.35) GPR84SPHK1LMNA
SCHEMBL6911461 0.79 NR1I2 (0.41) LMNA
SCHEMBL5482895 0.78 GPR84 (0.42) MAPTGPR84SPHK1FFAR1LMNA
Hexane SCHEMBL28866581 0.78 SOAT1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082357-B1 METHOD FOR OLEFIN POLYMERIZATION WITH RECYCLING OF CO-CATALYST LG CHEMICAL LTD (KR) 2004-11-17 EP disclosed
EP-1214357-B1 METALLOCENE COMPOUNDS AND THEIR USE FOR OLEFIN POLYMERIZATION LG CHEMICAL LTD (KR) 2003-08-20 EP disclosed
US-6506919-B1 Catalyst with reactive functional group leads to highly active supported catalyst which can provide polymers with superior morphology and bulk density and minimize fouling of reactor LG CHEMICAL CO., LTD. (KR) 2003-01-14 US disclosed
EP-1214357-A4 METALLOCENE COMPOUNDS AND THEIR USE FOR OLEFIN POLYMERIZATION LG CHEMICAL LTD (KR) 2002-10-25 EP disclosed
EP-1214357-A1 METALLOCENE COMPOUNDS AND THEIR USE FOR OLEFIN POLYMERIZATION LG Chemical Co. Ltd (KR) 2002-06-19 EP disclosed
US-6340728-B1 OLEFIN POLYMERIZATION WITH RECYCLED COCATALYST, SOLVENTS LC CHEMICAL LTD. (KR) 2002-01-22 US disclosed
EP-1082357-A1 METHOD FOR OLEFIN POLYMERIZATION WITH RECYCLING OF CO-CATALYST LG Chemical Ltd. (KR) 2001-03-14 EP disclosed
WO-2000052063-A1 METALLOCENE COMPOUNDS AND THEIR USE FOR OLEFIN POLYMERIZATION LG CHEMICAL CO., LTD. (KR) 2000-09-08 WO disclosed
WO-2000047635-A1 METHOD FOR OLEFIN POLYMERIZATION WITH RECYCLING OF CO-CATALYST LG CHEMICAL LTD. (KR) 2000-08-17 WO disclosed