SCHEMBL4627971

SCHEMBL4627971

CCOC(=O)c1cc(C)c(CC)c(C(C)(C)C)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.40
TSHR P16473 1/20 0.39
GAA P10253 1/20 0.38
LMNA P02545 2/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA7 P43166 2/20 0.37
CA9 Q16790 2/20 0.37
CA14 Q9ULX7 2/20 0.37
IGF1R P08069 1/20 0.37
CYP3A4 P08684 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL4628190 0.86 CYP4F2 (0.40) MAPK1TSHRGAALMNACA12
SCHEMBL4625610 0.86 MAPK1 (0.39) MAPK1TSHRGAALMNACA12
SCHEMBL4627086 0.83 MAPK1 (0.40) MAPK1TSHRGAALMNACA12
SCHEMBL4627406 0.83 CA1 (0.40) MAPK1TSHRLMNACA12CA1
SCHEMBL4628680 0.82 TSHR (0.38) MAPK1TSHRGAALMNACA12
SCHEMBL4626502 0.82 MAPK1 (0.41) MAPK1TSHRGAALMNACA12
SCHEMBL4628622 0.80 MAPK1 (0.39) MAPK1TSHRGAALMNACA12
SCHEMBL4627101 0.80 MAPK1 (0.39) MAPK1TSHRGAALMNACA12
SCHEMBL4627938 0.78 TSHR (0.46) MAPK1TSHRLMNACA12CA1
SCHEMBL4626577 0.78 TSHR (0.39) MAPK1TSHRGAALMNACA12

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