SCHEMBL4627359

SCHEMBL4627359

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

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.61
TSHR P16473 2/20 0.61
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
MAPT P10636 4/20 0.47
GAA P10253 2/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
TP53 P04637 2/20 0.47
NPY1R P25929 1/20 0.47
NPY2R P49146 1/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.46
ADRB2 P07550 2/20 0.46
ADRB1 P08588 2/20 0.46

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
SCHEMBL302337 0.95 ALDH1A1 (0.67) ALDH1A1TSHRCA12CA1CA2
SCHEMBL302145 0.89 TSHR (0.66) ALDH1A1TSHRCA12CA1CA2
SCHEMBL27553264 0.88 ALDH1A1 (0.61) ALDH1A1TSHRCA12CA1CA2
SCHEMBL4627967 0.88 TSHR (0.56) ALDH1A1TSHRCA2MAPTKMT2A
Ammonia Solution, Strong SCHEMBL28127857 0.87 ALDH1A1 (0.59) ALDH1A1TSHRCA12CA1CA2
SCHEMBL4627588 0.87 ALDH1A1 (0.59) ALDH1A1TSHRCA12CA1CA2
SCHEMBL28146886 0.87 ALDH1A1 (0.59) ALDH1A1TSHRCA12CA1CA2
SCHEMBL4843311 0.86 ALDH1A1 (0.59) ALDH1A1TSHRCA12CA1CA2
SCHEMBL7059492 0.86 ALDH1A1 (0.76) ALDH1A1TSHRCA12CA1CA2
SCHEMBL4627169 0.86 ALDH1A1 (0.58) ALDH1A1TSHRCA12CA1CA2

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