SCHEMBL30557927

SCHEMBL30557927

CC(=O)Nc1ccc(-c2nc3ccccn3c2CN2CCOCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 7/20 0.67
▸ KDM4E B2RXH2 4/20 0.67
▸ GAA P10253 2/20 0.67
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ MOK Q9UQ07 1/20 0.55
▸ CYP3A4 P08684 1/20 0.53
▸ KCNK3 O14649 6/20 0.53
▸ KCNK9 Q9NPC2 6/20 0.53

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
SCHEMBL30557935 0.88 CYP3A4 (0.67) SLC2A1KDM4EGAAALDH1A1CYP3A4
SCHEMBL30557946 0.84 CYP3A4 (0.76) SLC2A1KDM4EGAASMN1; SMN2ALDH1A1
SCHEMBL17718968 0.83 SLC2A1 (0.75) SLC2A1KDM4E
SCHEMBL28620843 0.83 SLC2A1 (0.82) SLC2A1KDM4EGAASMN1; SMN2ALDH1A1
SCHEMBL17718804 0.81 SLC2A1 (1.00) SLC2A1KDM4EGAA
SCHEMBL30557943 0.78 CYP3A4 (0.81) SLC2A1KDM4EGAACYP3A4KCNK3
SCHEMBL30557939 0.77 CYP3A4 (0.67) SLC2A1KDM4EGAAALDH1A1CYP3A4
SCHEMBL30557940 0.76 CYP3A4 (0.76) GAAALDH1A1RAB9ACYP3A4KCNK3
SCHEMBL30557923 0.76 CYP3A4 (0.71) SLC2A1KDM4EGAACYP3A4KCNK3
SCHEMBL30557932 0.76 CYP3A4 (0.65) SLC2A1KDM4EGAAALDH1A1CYP3A4

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
CN-115160313-B 2-phenylimidazole [1,2-a ] pyridine compound, composition containing same and application of 2-phenylimidazole [1,2-a ] pyridine compound and composition 中国药科大学 2023-09-05 — — CN disclosed
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