SCHEMBL987982

SCHEMBL987982

CCC(CC(C)=O)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
TSHR P16473 2/20 0.44
USP2 O75604 1/20 0.44
CA2 P00918 6/20 0.37
CA1 P00915 4/20 0.37
MAPK1 P28482 1/20 0.36
SLC1A3 P43003 1/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 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
SCHEMBL22472003 0.97 ALDH1A1 (0.43) ALDH1A1TDP1TSHRUSP2CA2
SCHEMBL2439880 0.85 ALDH1A1 (0.53) ALDH1A1TDP1TSHRUSP2HDAC7
SCHEMBL541995 0.82
SCHEMBL6844224 0.81 USP2 (0.42) TDP1TSHRUSP2CA2MAPK1
SCHEMBL123422 0.81 CA2 (0.50) ALDH1A1TDP1TSHRUSP2CA2
SCHEMBL8507722 0.80 TSHR (0.43) ALDH1A1TDP1TSHRUSP2CA2
Hydrochloric Acid SCHEMBL11428035 0.79
SCHEMBL22472002 0.79 USP2 (0.41) TDP1TSHRUSP2CA2MAPK1
SCHEMBL22472016 0.79 USP2 (0.41) TDP1TSHRUSP2CA2MAPK1
SCHEMBL11534220 0.79 ALDH1A1 (0.42) ALDH1A1TDP1TSHRUSP2CA2

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166009-A1 Ink For Producing Catalyst Layers UMICORE AG & CO. KG (DE) 2011-07-07 US claimed
US-7906452-B2 high storage stability; for producing catalyst-coated substrates for electrochemical devices, in particular fuel cells; stable to oxidative degradation UMICORE AG & CO. KG (DE) 2011-03-15 US claimed
US-20080191161-A1 Ink for Producing Catalyst Layers UMICORE AG & CO. KG (DE) 2008-08-14 US claimed
EP-1872425-A1 INK FOR PRODUCING CATALYST LAYERS Umicore AG & Co. KG (DE) 2008-01-02 EP claimed
WO-2006103035-A1 INK FOR PRODUCING CATALYST LAYERS UMICORE AG & CO. KG (DE) 2006-10-05 WO claimed
EP-2735581-B1 COMPOSITION AND POLYMER ASAHI CHEMICAL IND (JP) 2021-07-14 EP disclosed
US-9738757-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-08-22 US disclosed
EP-2273591-B1 Ink for producing catalyst layers UMICORE AG & CO KG (DE) 2017-05-31 EP disclosed
WO-2017079016-A1 LUBRICANT WITH HIGH PYROPHOSPHATE LEVEL THE LUBRIZOL CORPORATION (US) 2017-05-11 WO disclosed
US-9567301-B2 Pyrrol-1-yl benzoic acid derivatives useful as myc inhibitors DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-02-14 US disclosed
US-9540320-B2 2017-01-10 US disclosed
US-9518091-B2 A4B7 peptide monomer and dimer antagonists PROTAGONIST THERAPEUTICS, INC. 2016-12-13 US disclosed
US-7906452-B2 high storage stability; for producing catalyst-coated substrates for electrochemical devices, in particular fuel cells; stable to oxidative degradation UMICORE AG & CO. KG (DE) 2011-03-15 US disclosed
EP-2273591-A2 Ink for producing catalyst layers UMICORE AG & CO. KG (DE) 2011-01-12 EP disclosed
US-7476759-B2 e.g. 4-Amino-3-(4'-cyano-1,1'-biphenyl-4-yl)-4-oxobutanoic acid; antiinflammatory , anticarcinogenic, antiasthmatic agent; autoimmune disorder; osteoarthritis, rubella, Alzheimer's, Parkinson's diseases, epilepsy, osteoporosis GLAXO GROUP LIMITED (GB) 2009-01-13 US disclosed
US-20080191161-A1 Ink for Producing Catalyst Layers UMICORE AG & CO. KG (DE) 2008-08-14 US disclosed
EP-1872425-A1 INK FOR PRODUCING CATALYST LAYERS Umicore AG & Co. KG (DE) 2008-01-02 EP disclosed
WO-2006103035-A1 INK FOR PRODUCING CATALYST LAYERS UMICORE AG & CO. KG (DE) 2006-10-05 WO disclosed
US-4908316-A Biologically pure culture PFIZER INC. (US) 1990-03-13 US disclosed
US-4751317-A ANTIPROTOZOA AGENT PFIZER INC. (US) 1988-06-14 US disclosed