SCHEMBL6609911

SCHEMBL6609911

Cc1ccc(C)c(N2CC(OC(=O)Nc3ccc(-c4ccccc4)cc3)CC2=O)c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
FAAH O00519 1/20 0.41
MGLL Q99685 1/20 0.41
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
CHRNA7 P36544 2/20 0.38
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38

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
SCHEMBL6615605 0.92 MGLL (0.52) MAPTFAAHMGLLALDH1A1TP53
SCHEMBL6608759 0.92 MAPT (0.43) MAPTHSD17B10ALDH1A1SMN1; SMN2NPSR1
SCHEMBL6610439 0.90 MAPT (0.45) MAPTALDH1A1SMN1; SMN2LMNATP53
SCHEMBL6610923 0.89 HSD17B10 (0.42) MAPTHSD17B10ALDH1A1SMN1; SMN2NPSR1
SCHEMBL6616178 0.89 SMN1; SMN2 (0.47) MAPTHSD17B10ALDH1A1SMN1; SMN2NPSR1
SCHEMBL6611117 0.89 MAPT (0.41) MAPTHSD17B10ALDH1A1SMN1; SMN2NPSR1
SCHEMBL6610069 0.88 MEN1 (0.43) MAPTALDH1A1SMN1; SMN2LMNATP53
SCHEMBL6614360 0.87 MEN1 (0.41) MAPTHSD17B10ALDH1A1SMN1; SMN2NPSR1
SCHEMBL6615199 0.87 MAPK1 (0.47) MAPTHSD17B10ALDH1A1SMN1; SMN2TP53
SCHEMBL6609668 0.86 MAPT (0.40) MAPTALDH1A1SMN1; SMN2NPSR1LMNA

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
EP-1463724-A1 PYRROLIDONE CARBOXAMIDES Actelion Pharmaceuticals Ltd. (CH) 2004-10-06 EP disclosed
WO-2003059905-A1 PYRROLIDONE CARBOXAMIDES ACTELION PHARMACEUTICALS LTD (CH) 2003-07-24 WO disclosed