SCHEMBL6763587

SCHEMBL6763587

CCC(=O)Cc1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.53
PKM P14618 1/20 0.53
ITK Q08881 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 5/20 0.47
MAPT P10636 5/20 0.47
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2B Q13224 2/20 0.40
GRIN2C Q14957 2/20 0.40

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
SCHEMBL6772737 0.83 GAA (0.56) GAAPKMMEN1KMT2APOLB
SCHEMBL1827547 0.81 MAPT (0.62) GAAPKMMEN1KMT2APOLB
SCHEMBL6763567 0.80 SMN1; SMN2 (0.54) GAAPKMMEN1KMT2APOLB
SCHEMBL6766026 0.80 ALDH1A1 (0.56) GAAPKMMEN1KMT2APOLB
SCHEMBL6763762 0.79 GAA (0.61) GAAPKMITKMEN1KMT2A
SCHEMBL6763502 0.79 MEN1 (0.56) GAAPKMMEN1KMT2APOLB
SCHEMBL6768025 0.79 PARP1 (0.58) GAAPKMMEN1KMT2APOLB
SCHEMBL6768474 0.79 GAA (0.51) GAAPKMMEN1KMT2APOLB
SCHEMBL2056376 0.78 GAA (0.63) GAAPKMMEN1KMT2APOLB
SCHEMBL5393113 0.75 GAA (0.59) GAAPKMMEN1KMT2APOLB

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