SCHEMBL4627645

SCHEMBL4627645

CCOC(=O)c1cc(C)c(C)cc1C(=O)OCC(C)C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
TSHR P16473 2/20 0.58
GPR35 Q9HC97 1/20 0.46
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA7 P43166 3/20 0.45
CA9 Q16790 3/20 0.45
CA14 Q9ULX7 3/20 0.45
KDM4E B2RXH2 3/20 0.44
MAPT P10636 4/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 2/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
NPC1 O15118 2/20 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
SCHEMBL4627198 0.94 TSHR (0.63) ALDH1A1TSHRGPR35KDM4EMAPT
SCHEMBL4625701 0.90 ALDH1A1 (0.51) ALDH1A1TSHRGPR35CA12CA1
SCHEMBL4641058 0.90 ALDH1A1 (0.51) ALDH1A1TSHRGPR35CA12CA1
SCHEMBL4627319 0.89 ALDH1A1 (0.50) ALDH1A1TSHRGPR35CA12CA1
SCHEMBL6911156 0.89 ALDH1A1 (0.50) ALDH1A1TSHRGPR35CA12CA1
SCHEMBL4625661 0.89 ALDH1A1 (0.50) ALDH1A1TSHRGPR35CA12CA1
SCHEMBL4625958 0.89 ALDH1A1 (0.50) ALDH1A1TSHRGPR35CA12CA1
SCHEMBL4627285 0.88 ALDH1A1 (0.56) ALDH1A1TSHRGPR35CA12CA1
SCHEMBL4625850 0.87 TSHR (0.61) ALDH1A1TSHRCA12CA1CA2
SCHEMBL4628580 0.86 ALDH1A1 (0.54) ALDH1A1TSHRGPR35CA12CA1

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