SCHEMBL31542040

SCHEMBL31542040

CCNCc1cc(O)c(O)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.39
SELL P14151 2/20 0.39
SELP P16109 2/20 0.39
SELE P16581 2/20 0.39
TRPA1 O75762 1/20 0.37
IGF1R P08069 3/20 0.36
HSD17B10 Q99714 2/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.35
LMNA P02545 3/20 0.34
KDM4E B2RXH2 2/20 0.34
POLB P06746 2/20 0.34
GAA P10253 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
NFKB1 P19838 1/20 0.34
XDH P47989 1/20 0.34
GFER P55789 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34

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
SCHEMBL23750505 0.83 GSR (0.44) GSRSELLSELPSELEIGF1R
SCHEMBL2228043 0.79 TRPA1 (0.36) GSRSELLSELPSELETRPA1
SCHEMBL22249384 0.78 MAPT (0.41) SELLSELPSELEHSD17B10ALOX15
SCHEMBL12471961 0.78 TRPA1 (0.59) TRPA1IGF1RHSD17B10CYP2C9ALOX15
Bromide SCHEMBL30912126 0.77 TRPA1 (0.57) TRPA1IGF1RHSD17B10CYP2C9ALOX15
SCHEMBL6660623 0.75 GSR (0.69) GSRCYP2C9ALOX15LMNAKDM4E
Hydrochloric Acid SCHEMBL8843543 0.74 GSR (0.70) GSRCYP2C9ALOX15LMNAKDM4E
SCHEMBL1173905 0.73 HTT (0.52) SELLSELPSELETRPA1HSD17B10
SCHEMBL23750511 0.73 LMNA (0.39) SELLSELPSELEIGF1RHSD17B10
SCHEMBL1173818 0.72 TRPA1 (0.56) SELLSELPSELETRPA1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119639278-A Liquid ink containing charge director nano particles 上海蓝帕新材料科技有限公司 2025-03-18 CN claimed