SCHEMBL222221

SCHEMBL222221

O=CC(=O)c1ccc(C(=O)C=O)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.74
TDP1 Q9NUW8 3/20 0.74
MAPK1 P28482 1/20 0.74
KMT2A Q03164 5/20 0.48
HTT P42858 4/20 0.48
LMNA P02545 4/20 0.48
NPSR1 Q6W5P4 3/20 0.48
MEN1 O00255 3/20 0.48
PKM P14618 2/20 0.48
ATM Q13315 2/20 0.48
HPGD P15428 2/20 0.48
NLRP1 Q9C000 1/20 0.48
NTSR1 P30989 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ALDH5A1 P51649 1/20 0.46
ABAT P80404 1/20 0.46
MAPT P10636 6/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
AKT1 P31749 1/20 0.42

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
Water SCHEMBL11592745 0.97 ALDH1A1 (0.70) ALDH1A1TDP1MAPK1KMT2AHTT
Water SCHEMBL11592742 0.97 ALDH1A1 (0.70) ALDH1A1TDP1MAPK1KMT2AHTT
SCHEMBL11530261 0.91 ALDH1A1 (0.64) ALDH1A1TDP1MAPK1KMT2AHTT
Xenygloxal SCHEMBL2110325 0.91 ALDH1A1 (0.64) ALDH1A1TDP1MAPK1KMT2AHTT
Xenygloxal SCHEMBL11410527 0.89 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1KMT2AHTT
SCHEMBL2181913 0.89 ALDH1A1 (0.68) ALDH1A1TDP1MAPK1KMT2ASMN1; SMN2
SCHEMBL361345 0.89 ALDH5A1 (0.62) ALDH1A1TDP1MAPK1KMT2AHTT
Xenygloxal SCHEMBL11411015 0.89 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1KMT2AHTT
SCHEMBL3060903 0.87 TDP1 (0.58) ALDH1A1TDP1MAPK1KMT2AHTT
SCHEMBL3045890 0.87 ALDH1A1 (0.58) ALDH1A1TDP1MAPK1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4197395-A Crosslinking of mercaptan containing polymers with polyaldehyde compounds POLYSAR LIMITED (CA) 1980-04-08 US claimed
US-4100137-A Crosslinking of hydroxyl-containing polymers with polyaldehyde compounds POLYSAR LIMITED (CA) 1978-07-11 US claimed
US-4005053-A Polymer-oil-black masterbatch POLYSAR LIMITED (CA) 1977-01-25 US claimed
JP-1054018-A None JP disclosed
US-20180118590-A1 OXIDATION METHOD AUCKLAND UNISERVICES LIMITED (NZ) 2018-05-03 US disclosed
EP-3285924-A1 OXIDATION METHOD Auckland Uniservices Limited (NZ) 2018-02-28 EP disclosed
EP-1940841-B9 COMPOUNDS COMPRISING A BIOLOGICAL TARGET RECOGNIZING PART, COUPLED TO A SIGNAL PART CAPABLE OF COMPLEXING GALLIUM GUERBET SA (FR) 2017-04-19 EP disclosed
EP-1940841-B1 COMPOUNDS COMPRISING A BIOLOGICAL TARGET RECOGNIZING PART, COUPLED TO A SIGNAL PART CAPABLE OF COMPLEXING GALLIUM GUERBET SA (FR) 2016-12-07 EP disclosed
WO-2016171572-A1 OXIDATION METHOD AUCKLAND UNISERVICES LIMITED (NZ) 2016-10-27 WO disclosed
US-9080000-B2 Method of forming a non-random copolymer DOW CORNING CORPORATION (US) 2015-07-14 US disclosed
EP-2393855-B1 METHOD OF FORMING A NON-RANDOM COPOLYMER DOW CORNING (US) 2015-06-17 EP disclosed
WO-1998018496-A2 CONTRAST AGENTS NYCOMED IMAGING AS (NO) 1998-05-07 WO disclosed
WO-1998018497-A2 CONTRAST AGENTS NYCOMED IMAGING AS (NO) 1998-05-07 WO disclosed
EP-0562624-A2 Stabilization of functional proteins Modrovich, Ivan E. (US) 1993-09-29 EP disclosed
US-4366277-A STABILIZERS FOR POLYMERS; PHOTOSTABILITY; HEAT RESISTANCE CARSTAB CORPORATION (US) 1982-12-28 US disclosed
US-4356279-A HEAT AND LIGHT STABILIZERS CARSTAB CORPORATION (US) 1982-10-26 US disclosed
EP-0033663-A1 2,2,6,6-Tetramethyl-4-piperidyl - substituted heterocyclic ring compounds, a method for their preparation and polymers containing the same CARSTAB CORPORATION (US) 1981-08-12 EP disclosed
US-4101510-A SUBSTITUTED VINYL AROMATIC MONOMER, LEWIS ACID STANDARD OIL COMPANY A CORPORATION OF INDIANA (US) 1978-07-18 US disclosed
US-4087409-A USED TO SPIN FIBERS MONSANTO COMPANY (US) 1978-05-02 US disclosed
US-4005053-A Polymer-oil-black masterbatch POLYSAR LIMITED (CA) 1977-01-25 US disclosed