SCHEMBL28548771

SCHEMBL28548771

CCOC(=O)c1ccccc1/N=N/c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
MAPT P10636 10/20 0.58
SMN1; SMN2 Q16637 7/20 0.58
L3MBTL1 Q9Y468 6/20 0.58
MAPK1 P28482 5/20 0.58
LMNA P02545 4/20 0.58
TP53 P04637 3/20 0.58
ALDH1A1 P00352 2/20 0.58
ACHE P22303 1/20 0.57
KMT2A Q03164 7/20 0.53
MEN1 O00255 5/20 0.53
TDP1 Q9NUW8 4/20 0.53
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
HSD17B10 Q99714 1/20 0.53
IDE P14735 1/20 0.50
HTT P42858 5/20 0.49
POLB P06746 1/20 0.49
MYC P01106 1/20 0.49
GAA P10253 1/20 0.47

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
SCHEMBL9614458 0.90 IDE (0.61) TSHRMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL9328655 0.90 IDE (0.61) TSHRMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL11763598 0.82 MAPT (0.46) TSHRMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL11763596 0.82 MAPT (0.46) TSHRMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL28098512 0.82 MAPT (0.62) TSHRMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL29021505 0.82 MAPT (0.62) TSHRMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL439436 0.81 TSHR (0.65) TSHRMAPTL3MBTL1MAPK1LMNA
SCHEMBL7992543 0.80 TSHR (0.69) TSHRMAPTL3MBTL1MAPK1LMNA
Diethyl Phthalate SCHEMBL28775845 0.79 TSHR (0.95) TSHRL3MBTL1MAPK1LMNATP53
Diethyl Phthalate SCHEMBL19252611 0.79 TSHR (0.95) TSHRL3MBTL1MAPK1LMNATP53

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-108273478-B Formaldehyde removal composition and product 李怀玉 2021-03-02 CN disclosed