SCHEMBL6767964

SCHEMBL6767964

CN(C)C(=O)CCc1cccc2[nH]c(=O)[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.45
SRC P12931 1/20 0.45
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2A Q12879 2/20 0.42
GRIN2B Q13224 2/20 0.42
GRIN2C Q14957 2/20 0.42
GRIN3A Q8TCU5 2/20 0.42
KDM4E B2RXH2 1/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
P2RY12 Q9H244 1/20 0.38
CDK4 P11802 1/20 0.37
NR4A1 P22736 1/20 0.36
NR4A2 P43354 1/20 0.36
NR4A3 Q92570 1/20 0.36
IAPP P10997 1/20 0.36
HAT1 O14929 2/20 0.35
EP300 Q09472 2/20 0.35

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
SCHEMBL6766045 0.85 GRIN2D (0.51) EGFRSRCGRIN2DGRIN3BGRIN1
SCHEMBL6767981 0.85 IAPP (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6772930 0.81 GRIN2D (0.45) EGFRSRCGRIN2DGRIN3BGRIN1
SCHEMBL6766321 0.81 CYP4F2 (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6763570 0.80 ALDH1A1 (0.47) EGFRSRCGRIN2DGRIN3BGRIN1
SCHEMBL6763616 0.80 GRIN2D (0.46) EGFRSRCGRIN2DGRIN3BGRIN1
SCHEMBL6767952 0.77 GRIN2D (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5388796 0.77 DAO (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6763595 0.76 GRIN2D (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL21274659 0.75 BCHE (0.50)

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