SCHEMBL21148006

SCHEMBL21148006

COCCC(=O)OCN1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
TSHR P16473 2/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 2/20 0.44
ALDH1A1 P00352 4/20 0.43
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 1/20 0.41
GLA P06280 2/20 0.41
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37

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
SCHEMBL21148002 0.91 TDP1 (0.43) TDP1TSHRLMNAPOLBALDH1A1
SCHEMBL26920149 0.91 TDP1 (0.43) TDP1TSHRLMNAPOLBALDH1A1
SCHEMBL20280767 0.85 ALDH1A1 (0.57) TDP1LMNAALDH1A1L3MBTL1KMT2A
SCHEMBL19954046 0.80 MEN1 (0.47) KMT2ASMN1; SMN2
SCHEMBL21147999 0.79 TSHR (0.47) TDP1TSHRLMNAPOLBALDH1A1
SCHEMBL64493 0.79 TDP1 (0.54) TDP1TSHRLMNAPOLBALDH1A1
SCHEMBL17281301 0.78 DGKA (0.51) TDP1TSHRLMNAPOLBALDH1A1
SCHEMBL20280408 0.77 ALDH1A1 (0.52) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL20280768 0.77 ALDH1A1 (0.52) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL17892556 0.76 TDP1 (0.50) TDP1TSHRPOLBALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11839700-B2 Bio-electrode composition, bio-electrode, and method for manufacturing a bio-electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-12 US disclosed
US-11839700-B2 Bio-electrode composition, bio-electrode, and method for manufacturing a bio-electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-12 US disclosed
US-20190209740-A1 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING A BIO-ELECTRODE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-07-11 US disclosed