SCHEMBL6768232

SCHEMBL6768232

CNC(=O)OCc1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.47
PKM P14618 1/20 0.47
KDM4E B2RXH2 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAPT P10636 6/20 0.43
ALDH1A1 P00352 6/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 2/20 0.41
G6PD P11413 1/20 0.41
BLM P54132 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 2/20 0.41
MCL1 Q07820 1/20 0.41
LMNA P02545 1/20 0.40
TOP2A P11388 1/20 0.40
TOP2B Q02880 1/20 0.40
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL6766474 0.86 GAA (0.45) GAAPKMKDM4ETDP1MAPT
SCHEMBL6763601 0.79 GAA (0.47) GAAPKMKDM4ETDP1MAPT
SCHEMBL6763502 0.77 MEN1 (0.56) GAAPKMKDM4ETDP1MAPT
SCHEMBL6763499 0.76 GAA (0.58) GAAPKMKDM4EMAPTALDH1A1
SCHEMBL6772923 0.75 GAA (0.49) GAAPKMKDM4ETDP1MAPT
SCHEMBL6763547 0.75 TSHR (0.56) GAAPKMKDM4EMAPTALDH1A1
SCHEMBL6773336 0.74 TSHR (0.58) GAAPKMKDM4ETDP1MAPT
SCHEMBL11205908 0.74 MGLL (0.47) ALDH1A1MEN1KMT2ALMNATOP2A
SCHEMBL6768474 0.74 GAA (0.51) GAAPKMKDM4ETDP1MAPT
SCHEMBL28266629 0.73 TOP2A (0.44) MAPTALDH1A1POLBTOP2ATOP2B

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