SCHEMBL4625817

SCHEMBL4625817

CCOC(=O)c1cc(CC)c(CC)cc1C(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
MAPK1 P28482 2/20 0.47
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
GAA P10253 2/20 0.44
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA7 P43166 3/20 0.44
CA9 Q16790 3/20 0.44
CA14 Q9ULX7 3/20 0.44
IGF1R P08069 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.40

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
SCHEMBL6912185 0.92 MAPK1 (0.43) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL4626499 0.92 MAPK1 (0.43) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL4627094 0.89 CYP4F2 (0.43) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL4628188 0.89 CYP4F2 (0.43) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL6905640 0.89 MAPK1 (0.42) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL4625607 0.89 MAPK1 (0.42) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL4627116 0.88 TSHR (0.48) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL4627602 0.87 TSHR (0.59) TSHRMAPK1GAACA12CA1
SCHEMBL4626736 0.87 EGFR (0.36) TSHRMAPK1CRHBPCRHR2GAA
SCHEMBL4627261 0.85 CYP4F2 (0.48) TSHRMAPK1CRHBPCRHR2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1209172-B1 SOLID CATALYST COMPONENT AND CATALYST FOR OLEFIN POLYMERIZATION TOHO TITANIUM CO LTD (JP) 2008-07-02 EP disclosed
US-6770586-B2 Solid catalyst component and catalyst for olefins polymerization TOHO TITANIUM CO., LTD. (JP) 2004-08-03 US disclosed
US-20030130109-A1 Solid catalyst component and catalyst for olefins polymerization TOHO TITANIUM CO., LTD (JP) 2003-07-10 US disclosed
EP-1209172-A1 SOLID CATALYST COMPONENT AND CATALYST FOR OLEFIN POLYMERIZATION Toho Titanium Co., Ltd. (JP) 2002-05-29 EP disclosed