SCHEMBL8567876

SCHEMBL8567876

CCC[O-].CCC[O-].O=[Zr+2]

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
CES2 O00748 6/20 0.35
CES1 P23141 6/20 0.35
ALDH1A1 P00352 1/20 0.32
FFAR3 O14843 2/20 0.32
HDAC3 O15379 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
HDAC8 Q9BY41 2/20 0.32

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
SCHEMBL18092559 0.82 CES2 (0.35) CES2CES1FFAR3HDAC3HDAC1
SCHEMBL2729247 0.82 CES2 (0.35) CES2CES1FFAR3HDAC3HDAC1
SCHEMBL1787331 0.82 CES2 (0.35) TSHRCES2CES1FFAR3HDAC3
SCHEMBL16536152 0.82 CES2 (0.35) CES2CES1FFAR3HDAC3HDAC1
SCHEMBL15643453 0.80
SCHEMBL1976924 0.80 TSHR (0.33) TSHRTHRBCES2CES1
SCHEMBL6449559 0.80 TSHR (0.33) TSHRTHRBCES2CES1
SCHEMBL3658482 0.80 TSHR (0.33) TSHRTHRBCES2CES1
SCHEMBL3458910 0.80
SCHEMBL6448290 0.80 TSHR (0.33) TSHRTHRBCES2CES1

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-0652918-B1 ABRASIVE GRAIN WITH METAL OXIDE COATING, METHOD OF MAKING SAME AND ABRASIVE PRODUCTS MINNESOTA MINING & MFG (US) 1998-10-21 EP disclosed
US-5474583-A Alumina core with coating from hydrolyzing metal alkoxide to hydroxide, then sintering MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-12-12 US disclosed
EP-0652918-A1 ABRASIVE GRAIN WITH METAL OXIDE COATING, METHOD OF MAKING SAME AND ABRASIVE PRODUCTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-05-17 EP disclosed
WO-1994002560-A1 ABRASIVE GRAIN WITH METAL OXIDE COATING, METHOD OF MAKING SAME AND ABRASIVE PRODUCTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-02-03 WO disclosed