SCHEMBL6767005

SCHEMBL6767005

CCCOCc1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.51
PKM P14618 1/20 0.51
ALDH1A1 P00352 5/20 0.43
MAPT P10636 4/20 0.43
KMT2A Q03164 6/20 0.41
MEN1 O00255 5/20 0.41
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.38
ESR2 Q92731 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GRIA1 P42261 1/20 0.37
CACNG8 Q8WXS5 1/20 0.37
CDC25A P30304 1/20 0.37
CDC25B P30305 1/20 0.37
CDC25C P30307 1/20 0.37
DUSP3 P51452 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL6767882 0.87 GAA (0.54) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL7402915 0.84 GAA (0.51) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL6763499 0.80 GAA (0.58) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL5393113 0.78 GAA (0.59) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL6766396 0.77 GAA (0.51) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL2056376 0.77 GAA (0.63) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL13141189 0.76 GAA (0.62) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL6767845 0.73 MAPT (0.60) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL1824734 0.73 GAA (0.54) GAAPKMALDH1A1MAPTPOLB
SCHEMBL6768119 0.73 GAA (0.54) GAAPKMALDH1A1MAPTKMT2A

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-6699880-B1 STIMULATE MUSCARINIC ACETYLCHOLINE RECEPTORS M4, ANALGESICS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-02 US disclosed
EP-1221443-A1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-10 EP disclosed