SCHEMBL8944404

SCHEMBL8944404

CCCCCCOC(=O)Cc1cc(O)nc2ncnn12

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
NAAA Q02083 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
ESR1 P03372 1/20 0.37
AKR1C4 P17516 1/20 0.37
AKR1C3 P42330 1/20 0.37
AKR1C2 P52895 1/20 0.37
AKR1C1 Q04828 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL8944072 0.82 HTT (0.40) HTTGAASMN1; SMN2L3MBTL1NAAA
SCHEMBL22471842 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL22471796 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL31296569 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL22471808 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL22471833 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL22471812 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL22471828 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL22471805 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2
SCHEMBL31296581 0.65 HSP90AB1 (0.54) NAAAESR1AKR1C4AKR1C3AKR1C2

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-5480716-A MULTILAYER ELEMENT WITH SUPPORT AND MAGNETIC LAYER WITH FERROMAGNETIC METALS FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed