SCHEMBL3268261

SCHEMBL3268261

C=CC(=O)OC(CC(C)O)C(=C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.30

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
SCHEMBL9810911 0.77 TSHR (0.33) TSHR
SCHEMBL27913220 0.72 TSHR (0.42) TSHRHPGD
SCHEMBL28065350 0.72 HCAR2 (0.44) TSHR
SCHEMBL11207062 0.71 TSHR (0.39) TSHRHPGD
SCHEMBL28930602 0.70 TSHR (0.41) TSHRHPGD
SCHEMBL29240160 0.70 TSHR (0.43) TSHRHPGD
SCHEMBL16070994 0.70 TSHR (0.43) TSHRHPGD
Hydrogen Peroxide SCHEMBL28304770 0.69 TSHR (0.46) TSHRHPGD
SCHEMBL14877413 0.69
Methacrylic Acid SCHEMBL1274643 0.69 TSHR (0.39) TSHRHPGD

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-2398576-A1 HYDROPHILIC POROUS SUBSTRATES 3M Innovative Properties Company (US) 2011-12-28 EP disclosed
WO-2010096429-A1 HYDROPHILIC POROUS SUBSTRATES 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-08-26 WO disclosed
EP-2197945-A1 HYDROPHILIC POROUS SUBSTRATES 3M Innovative Properties Company (US) 2010-06-23 EP disclosed
WO-2009048933-A1 HYDROPHILIC POROUS SUBSTRATES 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-04-16 WO disclosed