SCHEMBL8854756

SCHEMBL8854756

CCOc1cc(Cc2cc(OCC)c(N3C(=O)C=CC3=O)c(OCC)c2)cc(OCC)c1N1C(=O)C=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.39
▸ FAAH O00519 1/20 0.39
▸ DHFR P00374 1/20 0.37
▸ MAPT P10636 3/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HSP90AA1 P07900 4/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ NPSR1 Q6W5P4 3/20 0.34
▸ CACNA1B Q00975 2/20 0.34
▸ APBA1 Q02410 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ CCR6 P51684 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL8854704 0.94 MAPT (0.40) MGLLFAAHDHFRMAPTTP53
SCHEMBL8854696 0.87 MGLL (0.37) MGLLFAAHMAPTTP53HSP90AA1
SCHEMBL8854681 0.85 MGLL (0.39) MGLLFAAHMAPTTP53TDP1
SCHEMBL8854743 0.82 HSP90AA1 (0.45) MGLLFAAHMAPTHSP90AA1ALDH1A1
SCHEMBL8854771 0.78 MGLL (0.38) MGLLFAAHMAPTTP53HSP90AA1
SCHEMBL184980 0.74 MGLL (0.46) MGLLFAAHMAPTHSP90AA1ALDH1A1
SCHEMBL184674 0.72 MGLL (0.45) MGLLFAAHMAPTTP53HSP90AA1
SCHEMBL8854665 0.71 MGLL (0.44) MGLLFAAHHSP90AA1CCR6
SCHEMBL8854671 0.70 MGLL (0.47) MGLLFAAHDHFRMAPTHSP90AA1
SCHEMBL8728920 0.70 ALDH1A1 (0.44) MGLLFAAHMAPTHSP90AA1ALDH1A1

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-5696235-A CONTAINING A BISMALEIMIDE; HEAT RESISTANCE, PROCESSABILITY; SOLUBLE IN VARIOUS ORGANIC SOLVENTS TOMOEGAWA PAPER CO., LTD. (JP) 1997-12-09 — — US disclosed
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