SCHEMBL3136361

SCHEMBL3136361

O=C1C=CC2=c3ccccc3=NC2=N1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
PKM P14618 1/20 0.31
MAPK10 P53779 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TGM2 P21980 1/20 0.30

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
SCHEMBL8905910 0.73
SCHEMBL201126 0.73
SCHEMBL7078914 0.71 MAOA (0.31) ALDH1A1MAPTMEN1LMNAPOLB
SCHEMBL29161382 0.63 MAPT (0.54) ALDH1A1MAPTMEN1LMNAPOLB
SCHEMBL31231126 0.62
SCHEMBL28728640 0.61 MAPT (0.41) ALDH1A1MAPTMEN1LMNAPOLB
SCHEMBL1924981 0.60 MAPT (0.38) ALDH1A1MAPTMEN1LMNAPOLB
SCHEMBL730638 0.60 MAPT (0.35) ALDH1A1MAPTMEN1LMNAPOLB
SCHEMBL4515373 0.60 ALDH1A1 (0.32) ALDH1A1MAPTMEN1LMNAPOLB
SCHEMBL8102526 0.60 MAP2K7 (0.42) ALDH1A1MAPTMEN1LMNAPOLB

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-1940840-B1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-07-21 EP disclosed
EP-1940840-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 EP disclosed
WO-2007045758-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-04-26 WO disclosed