SCHEMBL21112920

SCHEMBL21112920

COc1ccc2sc3ccccc3c(=O)c2c1.O=c1c2ccccc2sc2ccc(O)cc12

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.83
ALDH1A1 P00352 5/20 0.83
L3MBTL1 Q9Y468 4/20 0.83
TDP1 Q9NUW8 4/20 0.83
KDM4E B2RXH2 3/20 0.83
NPC1 O15118 3/20 0.83
RAB9A P51151 3/20 0.83
HCRTR1 O43613 2/20 0.51
POLB P06746 2/20 0.51
LMNA P02545 1/20 0.51
MAOA P21397 2/20 0.50
MAOB P27338 2/20 0.50
HSP90AA1 P07900 1/20 0.47
CYP1A2 P05177 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
PPARG P37231 1/20 0.47
NCOA2 Q15596 1/20 0.47
NCOA1 Q15788 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
SCHEMBL1880565 0.91 ALDH1A1 (1.00) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL29372602 0.91 ALDH1A1 (1.00) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL29359913 0.91 ALDH1A1 (1.00) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL29518570 0.87 KDM4E (0.64) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL44047 0.87 KDM4E (0.64) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL13343056 0.83 L3MBTL1 (0.54) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL30120715 0.83 KDM4E (0.83) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL26983883 0.83 KDM4E (0.83) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL4481328 0.82 ALDH1A1 (0.82) MAPTALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL31037131 0.82 ALDH1A1 (0.82) MAPTALDH1A1L3MBTL1TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10780027-B2 Composite material having reduced degradation of pasty property SHOFU INC. (JP) 2020-09-22 US disclosed
US-20190209439-A1 COMPOSITE MATERIAL HAVING REDUCED DEGRADATION OF PASTY PROPERTY SHOFU INC. (JP) 2019-07-11 US disclosed