SCHEMBL7529392

SCHEMBL7529392

Cn1cc(CC(N)=O)c2ccc(C3CCNC3)cc21

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.38
APP P05067 1/20 0.38
PDE4B Q07343 1/20 0.38
ICMT O60725 2/20 0.38
SLC6A4 P31645 1/20 0.37
JAK3 P52333 1/20 0.37
KHK P50053 1/20 0.37
USP25 Q9UHP3 2/20 0.36

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
SCHEMBL7528351 0.72 MAPT (0.46) ICMT
Hydrochloric Acid SCHEMBL30519937 0.71 HTR3A (0.50) JAK3
SCHEMBL18509896 0.70 FABP4 (0.45)
SCHEMBL22790044 0.70 NR4A2 (0.51) APPKHK
SCHEMBL18029041 0.70 MAPT (0.47) SLC6A4
SCHEMBL30958421 0.69 ICMT (0.62) ICMT
SCHEMBL588980 0.69 ICMT (0.62) ICMT
SCHEMBL8444605 0.69 CDK2 (0.50) ICMT
Hydrochloric Acid SCHEMBL3155846 0.68 ICMT (0.60) ICMT
SCHEMBL7593340 0.68 MAPT (0.46) JAK3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242409-A2 SUBSTITUTED BISINDOLYLMALEIMIDES F. HOFFMANN-LA ROCHE AG (CH) 2002-09-25 EP disclosed
US-6281356-B1 ANTICANRCER AGENTS HOFFMANN-LA ROCHE INC. 2001-08-28 US disclosed
WO-2001046178-A2 SUBSTITUIERTE BISINDOLYMALEIMIDE F. HOFFMANN-LA ROCHE AG (CH) 2001-06-28 WO disclosed