SCHEMBL3311945

SCHEMBL3311945

CC(COO)c1ccc(C(C)COO)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.41
ESR2 Q92731 3/20 0.41
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
ACHE P22303 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
TRPA1 O75762 3/20 0.35
RIPK1 Q13546 1/20 0.35
MIF P14174 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
ABCB11 O95342 1/20 0.34
CYP2C9 P11712 1/20 0.33
FFAR1 O14842 1/20 0.33

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
SCHEMBL8578308 0.91 ABCB11 (0.46) ESR1ESR2ALDH1A1TSHRACHE
SCHEMBL13731158 0.91 ACHE (0.48) ESR1ESR2ALDH1A1TSHRACHE
SCHEMBL8580830 0.88 TAAR1 (0.52) ALDH1A1TAAR1TRPA1RIPK1
SCHEMBL9695019 0.87 KIF11 (0.41) ESR1ESR2CYP2C9FFAR1
SCHEMBL12214814 0.85 ESR1 (0.40) ESR1ESR2ALDH1A1TSHRRIPK1
SCHEMBL9694465 0.85 ABCB11 (0.42) ESR1ESR2TRPA1ABCB11
SCHEMBL9614532 0.84 ABCB11 (0.53) TSHRABCB11CYP2C9
SCHEMBL19460546 0.81 HDAC4 (0.42) ALDH1A1TAAR1TRPA1RIPK1MIF
SCHEMBL12214812 0.78 ESR1 (0.46) ESR1ESR2ALDH1A1ACHE
SCHEMBL6058476 0.76 L3MBTL1 (0.38) ESR1ESR2ALDH1A1TSHRACHE

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723421-B2 Molding compositions with solid thermoplastic elastomer thickeners and products obtained therefrom Guzauskas, Robert (US) 2010-05-25 US disclosed
US-20070249774-A1 Molding compositions with solid thermoplastic elastomer thickeners and products obtained therefrom GUZAUSKAS ROBERT 2007-10-25 US disclosed
US-7183334-B2 Low temperature molding compositions with solid thermoplastic elastomer thickeners and fiber reinforcement REINFORCED POLYMERS, INC. (US) 2007-02-27 US disclosed
US-7132469-B2 Molding compositions with solid thermoplastic elastomer thickeners and products obtained therefrom REINFORCED POLYMERS, INC. (US) 2006-11-07 US disclosed
US-20040063845-A1 Molding compositions with solid thermoplastic elastomer thickeners and products obtained therefrom REINFORCED POLYMERS, INC. (US) 2004-04-01 US disclosed
US-20030134925-A1 Low temperature molding compositions with solid thermoplastic elastomer thickeners and fiber reinforcement REINFORCED POLYMERS, INC. 2003-07-17 US disclosed
US-6433037-B1 ACRYLIC RESIN ABSORBS FREE-RADICAL POLYMERIZABLE UNSATURATED MONOMER, OLIGOMER, OR POLYMER AND MATURES INTO MOLDABLE DOUGH; DENTISTRY, AUTOMOBILES, BATHROOM FIXTURES; LOW TEMPERATURE AND PRESSURE REINFORCED POLYMERS, INC. 2002-08-13 US disclosed
US-6103779-A MIXING SOLID ACRYLIC RESIN WITH ONE OR MORE LIQUID UNSATURATED MONOMERS, OLIGOMERS OR POLYMERS AND INSOLUBLE LONG FIBER REINFORCEMENT, AGING MIXTURE TO ALLOW SOLID RESIN TO ABSORB LIQUID REINFORCED POLMERS, INC. (US) 2000-08-15 US disclosed