SCHEMBL5339747

SCHEMBL5339747

CN1CCN(C(=O)c2cc(Cl)c3nc(-c4ccc(Cl)cc4)c(Br)n3c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.50
GABRA2 P47869 1/20 0.49
GABRB2 P47870 1/20 0.49
KMT2A Q03164 2/20 0.46
MKNK1 Q9BUB5 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
LMNA P02545 2/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
AOC3 Q16853 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
GMNN O75496 1/20 0.42
CYP3A4 P08684 1/20 0.42
TSPO P30536 1/20 0.42
BLM P54132 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FABP6 P51161 1/20 0.42
MEN1 O00255 1/20 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
SCHEMBL5335702 0.88 POLB (0.51) POLBGABRA2GABRB2KMT2AMKNK1
SCHEMBL5380026 0.85 GABRA2 (0.49) POLBGABRA2GABRB2KMT2AMKNK1
SCHEMBL5333366 0.82 POLB (0.49) POLBGABRA2GABRB2KMT2AMKNK1
SCHEMBL5343937 0.81 CDH1 (0.46) POLBLMNAGMNNCYP3A4TSPO
SCHEMBL5351210 0.78 CNR1 (0.54)
SCHEMBL5342230 0.78 CNR1 (0.56)
SCHEMBL5334428 0.77 TSPO (0.48) POLBGABRA2GABRB2LMNAGMNN
SCHEMBL5337506 0.76 PHGDH (0.51) KMT2ALMNATP53ALDH1A1MAPT
SCHEMBL5318714 0.73 POLB (0.56) POLBGABRA2GABRB2KMT2AMKNK1
SCHEMBL5317995 0.72 CNR1 (0.52) GABRA2GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007086080-A2 NOVEL IMIDAZO[1,2-a]PYRIDINE CANNABINOID RECEPTOR LIGANDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-08-02 WO disclosed