SCHEMBL3680561

SCHEMBL3680561

CCCCCCC(C)COC(=O)c1ccccc1C(=O)OCC(C)CCCCCC

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.72
PRSS2 P07478 1/20 0.72
PRSS3 P35030 1/20 0.72
ALDH1A1 P00352 9/20 0.62
CYP3A4 P08684 3/20 0.62
CA2 P00918 1/20 0.62
TSHR P16473 7/20 0.62
LMNA P02545 2/20 0.62
MAPK1 P28482 3/20 0.59
TP53 P04637 1/20 0.59
TDP1 Q9NUW8 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
HSD17B10 Q99714 2/20 0.51
KDM4E B2RXH2 2/20 0.51
POLB P06746 1/20 0.51
ACE2 Q9BYF1 1/20 0.42

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
SCHEMBL9620202 1.00 PRSS1 (0.72) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL4358832 0.98 PRSS1 (0.69) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL28117482 0.94 ALDH1A1 (0.71) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL7759401 0.94 ALDH1A1 (0.71) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL206454 0.94 ALDH1A1 (0.70) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL30112129 0.94 ALDH1A1 (0.70) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL27891834 0.93 ALDH1A1 (0.69) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL29662718 0.92 ALDH1A1 (0.73) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL28509428 0.90 LMNA (0.67) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL28295849 0.90 PRSS1 (0.80) PRSS1PRSS2PRSS3ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1985638-B1 Propylene copolymer, polypropylene composition, use thereof, transition metal compounds, and catalysts for olefin polymerization MITSUI CHEMICALS INC (JP) 2010-02-17 EP disclosed
EP-1988104-A1 Propylene copolymer, polypropylene composition, use thereof, transition metal compounds, and catalysts for olefin polymerization Mitsui Chemicals, Inc. (JP) 2008-11-05 EP disclosed
EP-1985637-A1 Propylene copolymer, polypropylene composition, use thereof, transition metal compounds, and catalysts for olefin polymerization Mitsui Chemicals, Inc. (JP) 2008-10-29 EP disclosed
EP-1985638-A1 Propylene copolymer, polypropylene composition, use thereof, transition metal compounds, and catalysts for olefin polymerization Mitsui Chemicals, Inc. (JP) 2008-10-29 EP disclosed
US-7160949-B2 Olefin block copolymers, processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-01-09 US disclosed
EP-1614699-A1 PROPYLENE COPOLYMER, POLYPROPYLENE COMPOSITION, USE THEREOF, TRANSITION METAL COMPOUNDS, AND CATALYSTS FOR OLEFIN POLYMERIZATION Mitsui Chemicals, Inc. (JP) 2006-01-11 EP disclosed
EP-1275670-B1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF MITSUI CHEMICALS INC (JP) 2005-08-10 EP disclosed
US-6583237-B1 Silyl-terminated olefin polymers; catalyst is transition metal cyclopentadiene compound, organoaluminum oxycompound, compounds that form an ion pair, organoaluminum compound, organosilicon compound, a dialkylzinc compound, and hydrogen MITSUI CHEMICALS, INC. (JP) 2003-06-24 US disclosed
US-20030055179-A1 Olefin block copolymers processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2003-03-20 US disclosed
EP-1275670-A1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-01-15 EP disclosed
EP-1270647-A1 BRANCHED POLYOLEFIN, PROCESS FOR PRODUCING THE SAME, AND THERMOPLASTIC RESIN COMPOSITION CONTAINING BRANCHED POLYOLEFIN Mitsui Chemicals, Inc. (JP) 2003-01-02 EP disclosed
EP-1092730-A1 PROCESS FOR PRODUCING OLEFIN POLYMER AND OLEFIN POLYMER Mitsui Chemicals, Inc. (JP) 2001-04-18 EP disclosed