SCHEMBL5319613

SCHEMBL5319613

CCCN1CCN(C(=O)c2ccc3nc(-c4ccc(Cl)cc4)c(-c4ccc(Cl)cc4)n3c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 10/20 0.52
KCNK3 O14649 2/20 0.50
KCNK9 Q9NPC2 2/20 0.50
SLC2A2 P11168 4/20 0.48
CNR1 P21554 1/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
CASP1 P29466 2/20 0.46
HSD17B10 Q99714 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
CASP7 P55210 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL5318714 0.89 POLB (0.56) SLC2A1KCNK3KCNK9CNR1KDM4E
SCHEMBL5341068 0.87 SLC2A2 (0.52) SLC2A1SLC2A2CNR1
SCHEMBL5341500 0.86 KMT2A (0.60) SLC2A1KCNK3KCNK9CNR1HPGD
SCHEMBL5322233 0.85 CNR1 (0.58) SLC2A1KCNK3KCNK9CNR1HSD17B10
SCHEMBL5337926 0.85 CNR1 (0.58) SLC2A1KCNK3KCNK9CNR1HSD17B10
SCHEMBL5339197 0.84 CASP1 (0.49) SLC2A1KCNK3KCNK9SLC2A2CNR1
SCHEMBL5336388 0.84 SLC2A2 (0.47) SLC2A1KCNK3KCNK9SLC2A2CNR1
SCHEMBL5342501 0.83 CCNC (0.45) SLC2A1KCNK3KCNK9CNR1KDM4E
SCHEMBL5345220 0.83 KDM4E (0.59) SLC2A1SLC2A2CNR1KDM4EALDH1A1
SCHEMBL5318501 0.82 MEN1 (0.58) SLC2A1KCNK3KCNK9CNR1KDM4E

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
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 claimed
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