SCHEMBL5335673

SCHEMBL5335673

O=C(NN1CCOCC1)c1cc(-c2ccc(Cl)cc2)c2nccn2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.55
CNR1 P21554 7/20 0.46
CNR2 P34972 4/20 0.43
SPTLC1 O15269 1/20 0.41
LIPE Q05469 1/20 0.41
CYP2D6 P10635 2/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
RAF1 P04049 2/20 0.39
BRAF P15056 2/20 0.39

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
SCHEMBL5342659 0.90 CNR1 (0.57) SMN1; SMN2CNR1CNR2
SCHEMBL5343151 0.80 CNR1 (0.49) CNR1CNR2SPTLC1MEN1KMT2A
SCHEMBL5342869 0.78 CNR1 (0.53) CNR1
SCHEMBL5343582 0.78 SPTLC1 (0.45) CNR1CNR2SPTLC1KDM4EMAPT
SCHEMBL5335422 0.78 SPTLC1 (0.45) CNR1SPTLC1
SCHEMBL5351052 0.78 SPTLC1 (0.50) SMN1; SMN2SPTLC1KDM4EMAPTALOX15
SCHEMBL5337097 0.74 SPTLC1 (0.53) SMN1; SMN2CNR1CNR2SPTLC1KDM4E
SCHEMBL5351259 0.74 MEN1 (0.46) CNR1CNR2MEN1KMT2A
SCHEMBL5335668 0.72 SMN1; SMN2 (0.62) SMN1; SMN2CNR1CYP2D6KDM4EMEN1
SCHEMBL5338836 0.71 SPTLC1 (0.49) SMN1; SMN2CNR1CNR2SPTLC1MAPT

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