SCHEMBL21755906

SCHEMBL21755906

Cc1cc(SO)c2c(C)ccc(C(C)C)cc1-2

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
PTGS1 P23219 2/20 0.47
TRPA1 O75762 1/20 0.47
CACNA1C Q13936 1/20 0.47
HTT P42858 2/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
ALOX12 P18054 1/20 0.42
HIF1A Q16665 1/20 0.42
UGT2B7 P16662 1/20 0.34
ACHE P22303 5/20 0.34
BCHE P06276 4/20 0.34
PTGS2 P35354 1/20 0.33
PDK2 Q15119 1/20 0.33
RNASEH1 O60930 1/20 0.33
TYR P14679 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
SCHEMBL17229433 0.84 LMNA (0.50) LMNAPTGS1TRPA1CACNA1CHTT
SCHEMBL17232524 0.79 LMNA (0.44) LMNAPTGS1TRPA1CACNA1CHTT
SCHEMBL29907971 0.78 LMNA (0.43) LMNAPTGS1TRPA1CACNA1CHTT
SCHEMBL29907922 0.78 LMNA (0.43) LMNAPTGS1TRPA1CACNA1CHTT
SCHEMBL29907954 0.75 LMNA (0.41) LMNAPTGS1TRPA1CACNA1CUGT2B7
SCHEMBL29907905 0.75 LMNA (0.41) LMNAPTGS1TRPA1CACNA1CALDH1A1
Guaiazulene Sulfonic Acid SCHEMBL2734180 0.73 LMNA (0.46) LMNAPTGS1TRPA1CACNA1CHTT
Guaiazulene Sulfonic Acid SCHEMBL31632205 0.73 LMNA (0.46) LMNAPTGS1TRPA1CACNA1CHTT
SCHEMBL15878674 0.73 LMNA (0.53) LMNAPTGS1TRPA1CACNA1CHTT
Guaiazulene Sulfonic Acid SCHEMBL9065336 0.72 LMNA (0.44) LMNAPTGS1TRPA1CACNA1CHTT

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
WO-2020040621-A1 COMPOSITION FOR PROMOTING DIFFERENTIATION OR PROLIFERATION OF HUMAN ADIPOSE STEM CELLS 주식회사 엘지생활건강 2020-02-27 WO disclosed