SCHEMBL7865757

SCHEMBL7865757

CCCCCCC(CCCCC(C)C)OC(=O)c1ccccc1C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.74
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
TSHR P16473 6/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 3/20 0.46
MAPK1 P28482 2/20 0.46
TP53 P04637 1/20 0.46
KDM4E B2RXH2 3/20 0.44
MEN1 O00255 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CA2 P00918 1/20 0.43
PTPN11 Q06124 2/20 0.41
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41

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
SCHEMBL11591181 1.00 ALDH1A1 (0.74) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL16892588 1.00 ALDH1A1 (0.74) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL233956 1.00 ALDH1A1 (0.74) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL234832 1.00 ALDH1A1 (0.74) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL10590872 1.00 ALDH1A1 (0.74) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL235626 1.00 ALDH1A1 (0.74) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL7867317 1.00 ALDH1A1 (0.74) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL7859280 0.99 ALDH1A1 (0.71) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL6402041 0.97 ALDH1A1 (0.70) ALDH1A1PRSS1PRSS2PRSS3TSHR
SCHEMBL2286877 0.97 ALDH1A1 (0.70) ALDH1A1PRSS1PRSS2PRSS3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773241-B1 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO LTD (JP) 2001-09-12 EP disclosed
EP-0811639-B1 SOLID CATALYTIC COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST TOHO TITANIUM CO LTD (JP) 2001-08-01 EP disclosed
US-5965478-A A POLYMERIZATION CATALYST IS A REACTION PRODUCT OF A TITANIUM HALIDE, A DIESTER OF AROMATIC DICARBOXYLIC ACID AND A DIALKOXYMAGNESIUM PARTICLES HAVING A HIGH BULK DENSITY; POLYOLEFIN HAVING A HIGH STEREOREGULARITY, HIGH BULK DENSITY TOHO TITANIUM CO., LTD. (JP) 1999-10-12 US disclosed
EP-0665243-B1 Catalyst for polymerization of olefins and process for polymerization of olefins using the same TOHO TITANIUM CO LTD (JP) 1999-07-07 EP disclosed
EP-0811639-A1 SOLID CATALYTIC COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST TOHO TITANIUM CO., LTD. (JP) 1997-12-10 EP disclosed
EP-0773241-A2 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO., LTD. (JP) 1997-05-14 EP disclosed
EP-0773240-A2 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO., LTD. (JP) 1997-05-14 EP disclosed
US-5547912-A FROM DIALKOXYMAGNESIUM COMPOUND, ALUMINUM COMPOUND, TITANIUM TETRACHLORIDE, AND DIESTER OF AROMATIC DICARBOXYLIC ACID TOHO TITANIUM CO., LTD. (JP) 1996-08-20 US disclosed
US-5498770-A DIALKOXYCYCLOHEXYLCYCLOPENTYLSILANE TOHO TITANIUM CO., LTD. (JP) 1996-03-12 US disclosed
WO-1995029939-A1 ORGANOSILICON COMPOUND, ZIEGLER-NATTA CATALYST CONTAINING THE SAME AND PROCESS FOR POLYMERIZATION OF OLEFINS TOHO TITANIUM CO., LTD. (JP) 1995-11-09 WO disclosed
EP-0665243-A2 Catalyst for polymerization of olefins and process for polymerization of olefins using the same TOHO TITANIUM CO., LTD. (JP) 1995-08-02 EP disclosed