SCHEMBL20168976

SCHEMBL20168976

Cc1ccc(Oc2ccc(S(=O)(=O)c3ccc(Oc4ccc(C(=O)OCc5ccccc5)cc4)cc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.68
HTT P42858 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
KMT2A Q03164 4/20 0.54
TDP1 Q9NUW8 2/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A3 Q01959 1/20 0.54
LMNA P02545 2/20 0.54
POLB P06746 1/20 0.53
ALDH1A1 P00352 2/20 0.51
HPGD P15428 1/20 0.51
PTGES O14684 1/20 0.49
ALOX5 P09917 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
NR3C1 P04150 1/20 0.47
GAA P10253 2/20 0.47
RAB9A P51151 2/20 0.47
MAPK14 Q16539 1/20 0.47
NPC1 O15118 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
SCHEMBL10930442 0.91 KMT2A (0.65) MAPTSMN1; SMN2KMT2ATDP1SLC6A2
SCHEMBL20168975 0.87 MAPT (0.60) MAPTHTTSMN1; SMN2KMT2ATDP1
SCHEMBL22927222 0.85 MAPT (0.57) MAPTSMN1; SMN2KMT2ATDP1SLC6A2
SCHEMBL6057219 0.84 KMT2A (0.76) MAPTSMN1; SMN2KMT2ATDP1SLC6A2
SCHEMBL10823522 0.84 KMT2A (0.76) MAPTSMN1; SMN2KMT2ATDP1SLC6A2
SCHEMBL20340356 0.82 MAPT (0.58) MAPTHTTSMN1; SMN2KMT2ATDP1
SCHEMBL9518321 0.82 KMT2A (0.73) MAPTSMN1; SMN2KMT2ATDP1SLC6A2
SCHEMBL17212838 0.81 KMT2A (0.63) MAPTKMT2ATDP1SLC6A2SLC6A3
SCHEMBL13407558 0.81 HTT (0.62) MAPTHTTSMN1; SMN2TDP1POLB
SCHEMBL13572436 0.81 HTT (0.62) MAPTHTTSMN1; SMN2TDP1POLB

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
US-9976063-B2 Polyarylether ketone imide sulfone adhesives THE BOEING COMPANY (US) 2018-05-22 US disclosed