SCHEMBL5699644

SCHEMBL5699644

C=C(CC(C)(C)[N+](=O)[O-])C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 5/20 0.55
HMGCR P04035 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
ADRA1A P35348 1/20 0.34
TET3 O43151 1/20 0.34
TET1 Q8NFU7 1/20 0.34
ALDH1A1 P00352 3/20 0.32
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL11672887 0.83 TET2 (0.50) TET2HMGCRCHRM1TBXA2RADRA1A
SCHEMBL2987704 0.80 ALDH1A1 (0.43) TET2ALDH1A1L3MBTL1
SCHEMBL19210054 0.79 TET2 (0.46) TET2TET3TET1
SCHEMBL19210071 0.79 TET2 (0.46) TET2TET3TET1
SCHEMBL27989041 0.79 ALDH1A1 (0.36) TET2ALDH1A1L3MBTL1
SCHEMBL19371488 0.78 TET2 (0.43) TET2TET3TET1
SCHEMBL2124560 0.78 HMGCR (0.52) HMGCRCHRM1TBXA2RADRA1AALDH1A1
SCHEMBL28212583 0.76 ALDH1A1 (0.38) TET2ALDH1A1L3MBTL1
SCHEMBL10436382 0.75 TET2 (0.47) TET2TET3TET1
SCHEMBL18497006 0.75 TET2 (0.67) TET2HMGCRCHRM1TBXA2RADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3847220-B1 UV-CURABLE HOT MELT ADHESIVE COMPOSITIONS FOR FLOORING APPLICATIONS BASF SE (DE) 2025-03-05 EP claimed
EP-3204444-B1 PHOSPHATE ESTER-MODIFIED ACRYLIC POLYOLS BASF SE (DE) 2023-08-30 EP claimed
EP-2931768-B1 NITROFUNCTIONAL ACRYLATE COPOLYMERS FOR BINDER COMPOSITIONS ANGUS CHEMICAL (US) 2017-08-16 EP claimed
US-20160033686-A1 POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY DEVICE AND MANUFACTURING METHOD OF POLARIZING PLATE PROTECTIVE FILM FUJIFILM CORPORATION (JP) 2016-02-04 US disclosed
EP-1687379-A1 WATER-BASED PIGMENT PREPARATIONS Clariant Produkte (Deutschland) GmbH (DE) 2006-08-09 EP disclosed
WO-2005042642-A1 WATER-BASED PIGMENT PREPARATIONS CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2005-05-12 WO disclosed
EP-1303549-B1 PARTIALLY BRANCHED POLYMERS BASF AG (DE) 2004-10-06 EP disclosed
EP-1303549-A2 PARTIALLY BRANCHED POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2003-04-23 EP disclosed
WO-2002006363-A2 PARTIALLY BRANCHED POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2002-01-24 WO disclosed