SCHEMBL4878068

SCHEMBL4878068

Clc1c[c]ccc1-n1cccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.44
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
LMNA P02545 2/20 0.42
GAA P10253 1/20 0.42
G6PD P11413 1/20 0.42
MAPK1 P28482 2/20 0.41
NPC1 O15118 1/20 0.41
TDO2 P48775 1/20 0.37
ADRA1A P35348 2/20 0.35
ADRA2A P08913 1/20 0.35
ADORA2A P29274 1/20 0.34
GRM5 P41594 2/20 0.33
MAT2A P31153 1/20 0.33
NPBWR1 P48145 1/20 0.32
ACLY P53396 1/20 0.32
F2RL1 P55085 1/20 0.32

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
SCHEMBL161297 0.79 ALDH1A1 (0.42) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL29001798 0.79 ALDH1A1 (0.42) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL7237526 0.77 KDM4E (0.40) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL27934781 0.76 TDO2 (0.44) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL27945389 0.76 ALDH1A1 (0.42) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL255914 0.76 MAPK1 (0.56) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL16370004 0.76 ALDH1A1 (0.39) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL21988636 0.73 KDM4E (0.40) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL28294729 0.73 MAPT (0.37) NOTUMALDH1A1KDM4EMEN1MAPT
SCHEMBL28050904 0.72 NOTUM (0.49) NOTUMALDH1A1KDM4ELMNAMAPK1

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-1919474-A1 PYRROLOPYRIDINE DERIVATIVES AND USE OF SAME AS PPAR RECEPTOR MODULATORS Laboratoires Fournier S.A. (FR) 2008-05-14 EP disclosed
WO-2007026104-A1 PYRROLOPYRIDINE DERIVATIVES AND USE OF SAME AS PPAR RECEPTOR MODULATORS LABORATOIRES FOURNIER S.A. (FR) 2007-03-08 WO disclosed