SCHEMBL23429896

SCHEMBL23429896

O=C(O)CCCC(CCC(=O)O)[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
MEN1 O00255 1/20 0.41
BLM P54132 1/20 0.41
HBB P68871 1/20 0.41
KMT2A Q03164 1/20 0.41
HIF1A Q16665 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.40
ENPEP Q07075 3/20 0.39
GSTK1 Q9Y2Q3 2/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
TET2 Q6N021 3/20 0.37
KDM4A O75164 2/20 0.37
KDM4C Q9H3R0 2/20 0.37
KDM2A Q9Y2K7 2/20 0.37
TET3 O43151 1/20 0.37
ANPEP P15144 1/20 0.36
FOLH1 Q04609 2/20 0.36
CAMK2A Q9UQM7 1/20 0.36

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
SCHEMBL23429906 0.96 LMNA (0.44) LMNAMEN1BLMHBBKMT2A
SCHEMBL23429927 0.94 LMNA (0.44) LMNAMEN1BLMHBBKMT2A
SCHEMBL23429940 0.92 LMNA (0.46) LMNASLC22A6ENPEPGSTK1TSHR
SCHEMBL23429908 0.92 LMNA (0.46) LMNASLC22A6ENPEPGSTK1TSHR
SCHEMBL23429930 0.92 LMNA (0.46) LMNASLC22A6ENPEPGSTK1TSHR
SCHEMBL23429911 0.92 LMNA (0.46) LMNASLC22A6ENPEPGSTK1TSHR
SCHEMBL23429939 0.92 LMNA (0.46) LMNASLC22A6ENPEPGSTK1TSHR
SCHEMBL23429924 0.92 LMNA (0.46) LMNASLC22A6ENPEPGSTK1TSHR
SCHEMBL23429903 0.92 LMNA (0.46) LMNASLC22A6ENPEPGSTK1TSHR
SCHEMBL23429943 0.92 GSTK1 (0.48) LMNAMEN1BLMHBBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230130031-A1 Thermoplastic Polyurethane Compositions Comprising Nitro-Substituted Polyester Diols NOVOLOOP INC (US) 2023-04-27 US disclosed
CN-115843302-A Thermoplastic polyurethane compositions comprising nitro-substituted polyester diols 诺弗洛普有限公司 2023-03-24 CN disclosed
CN-115843300-A Polymerizable compositions comprising nitro-substituted polyester diols 诺弗洛普有限公司 2023-03-24 CN disclosed
EP-4118126-A1 POLYMERIZABLE COMPOSITIONS COMPRISING NITRO-SUBSTITUTED POLYESTER DIOLS Novoloop, Inc. (US) 2023-01-18 EP disclosed
EP-4118131-A1 THERMOPLASTIC POLYURETHANE COMPOSITIONS COMPRISING NITRO-SUBSTITUTED POLYESTER DIOLS Novoloop, Inc. (US) 2023-01-18 EP disclosed
WO-2021183883-A1 THERMOPLASTIC POLYURETHANE COMPOSITIONS COMPRISING NITRO-SUBSTITUTED POLYESTER DIOLS BIOCELLECTION INC. (US) 2021-09-16 WO disclosed
WO-2021183891-A1 POLYMERIZABLE COMPOSITIONS COMPRISING NITRO-SUBSTITUTED POLYESTER DIOLS BIOCELLECTION INC. (US) 2021-09-16 WO disclosed
US-20210284793-A1 POLYMERIZABLE COMPOSITIONS COMPRISING NITRO-SUBSTITUTED POLYESTER DIOLS BIOCELLECTION INC. (US) 2021-09-16 US disclosed
US-11111334-B1 Polymerizable compositions comprising nitro substituted polyester diols BIOCELLECTION INC. (US) 2021-09-07 US disclosed
US-11028217-B1 Thermoplastic polyurethane compositions comprising nitro-substituted polyester diols BIOCELLECTION INC. (US) 2021-06-08 US disclosed