SCHEMBL4553955

SCHEMBL4553955

CCc1cccn2c(C(=O)C(=O)Nc3ccc(OC)nc3)c(-c3ccccc3)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.49
PDE4B Q07343 1/20 0.49
PDE4C Q08493 1/20 0.49
PDE4D Q08499 1/20 0.49
LMNA P02545 7/20 0.48
NPC1 O15118 3/20 0.48
PKM P14618 2/20 0.48
RAB9A P51151 5/20 0.47
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
ALDH1A1 P00352 6/20 0.42
HTT P42858 5/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
NPSR1 Q6W5P4 4/20 0.42
MAPT P10636 4/20 0.42
AGTR1 P30556 2/20 0.42
XBP1 P17861 1/20 0.42
MAPK1 P28482 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
PABPC1 P11940 3/20 0.42

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
SCHEMBL3887663 0.90 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1645267 0.89 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1645543 0.84 THRB (0.56) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1644501 0.80 LMNA (0.45) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1646043 0.78 LMNA (0.45) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1644316 0.78 THRB (0.48) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1646571 0.78 LMNA (0.45) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1644535 0.78 THRB (0.48) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1644333 0.77 THRB (0.48) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL3884080 0.76 LMNA (0.44) LMNANPC1RAB9AKMT2AMEN1

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-2097413-A1 2-[(2-SUBSTITUTED)-IND0LIZIN-3-YL]-2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G Limited (GB) 2009-09-09 EP disclosed
WO-2008062182-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD (GB) 2008-05-29 WO disclosed