SCHEMBL4627151

SCHEMBL4627151

CCOC(=O)c1cccc(C)c1C(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
ALDH1A1 P00352 3/20 0.47
HSD17B10 Q99714 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
GAA P10253 2/20 0.45
MAPT P10636 2/20 0.45
CDC25B P30305 3/20 0.44
CYP1A2 P05177 2/20 0.42
RAB9A P51151 2/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 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
SCHEMBL302145 0.87 TSHR (0.66) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL4627465 0.87 TSHR (0.53) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL4625853 0.85 TSHR (0.51) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL4626637 0.85 TSHR (0.51) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL4626983 0.85 TSHR (0.51) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL4628669 0.85 TSHR (0.51) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL4625657 0.84 TSHR (0.53) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL4627997 0.82 CA12 (0.38) TSHRCA12CA1CA2CA7
SCHEMBL27812272 0.82 TSHR (0.75) TSHRALDH1A1HSD17B10CRHBPCRHR2
SCHEMBL15724450 0.82 GRM6 (0.46) TSHRALDH1A1HSD17B10CA12CA1

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