SCHEMBL29018907

SCHEMBL29018907

O=[N+]([O-])c1cnc2ccccn12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.57
CYP2C9 P11712 1/20 0.57
NPSR1 Q6W5P4 2/20 0.47
PTGS1 P23219 2/20 0.45
PTGS2 P35354 2/20 0.45
ADORA3 P0DMS8 1/20 0.44
PKM P14618 2/20 0.43
FLT3 P36888 1/20 0.42
RAB9A P51151 4/20 0.41
MAPT P10636 1/20 0.41
ALOX5 P09917 1/20 0.41
NPC1 O15118 3/20 0.41
GGPS1 O95749 1/20 0.40
FDPS P14324 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MIF P14174 1/20 0.40

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
SCHEMBL2868554 0.75 CYP1A2 (0.49) CYP1A2CYP2C9MEN1KMT2ALMNA
SCHEMBL29845162 0.74 FLT3 (0.61) NPSR1PKMFLT3RAB9AMAPT
SCHEMBL5253694 0.72 CYP1A2 (0.67) CYP1A2CYP2C9MAPTMEN1KMT2A
SCHEMBL20125049 0.72 CYP1A2 (1.00) CYP1A2CYP2C9RAB9AMAPTALOX5
SCHEMBL18766625 0.72 CYP1A2 (0.67) CYP1A2CYP2C9FLT3MEN1KMT2A
SCHEMBL6742620 0.72 CYP1A2 (0.54) CYP1A2CYP2C9LMNAALDH1A1SMN1; SMN2
SCHEMBL1356256 0.72 CYP1A2 (0.67) CYP1A2CYP2C9FLT3RAB9AMEN1
SCHEMBL28921245 0.72 CYP1A2 (0.67) CYP1A2CYP2C9MAPTMEN1KMT2A
SCHEMBL29448938 0.71 PKM (0.44) NPSR1PTGS1PTGS2PKMFLT3
SCHEMBL31348009 0.70 NPC1 (0.67) PKMRAB9ANPC1LMNA

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
CN-116283967-A Preparation method of imidazopyridine derivative 安徽秀朗新材料科技有限公司 2023-06-23 CN claimed
CN-117003750-A Green synthesis method of imidazo [1,2-a ] pyridine compound 台州学院 2023-11-07 CN disclosed
CN-116283967-A Preparation method of imidazopyridine derivative 安徽秀朗新材料科技有限公司 2023-06-23 CN disclosed