SCHEMBL4312635

SCHEMBL4312635

O=C(O)c1ncnn1Cc1c(-c2ccc(Cl)cc2)nc2ccccn12

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.54
▸ KCNK3 O14649 11/20 0.54
▸ KCNK9 Q9NPC2 11/20 0.54
▸ GAA P10253 1/20 0.53
▸ SLC2A1 P11166 1/20 0.53
▸ NPC1 O15118 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ GABRA1 P14867 1/20 0.51
▸ GABRA5 P31644 1/20 0.51
▸ GABRB2 P47870 1/20 0.51

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
SCHEMBL1430637 0.90 KDM4E (0.56) KDM4EKCNK3KCNK9GAASLC2A1
SCHEMBL2202779 0.88 KDM4E (0.51) KDM4EKCNK3KCNK9GAASLC2A1
SCHEMBL1430117 0.88 KCNK3 (0.52) KDM4EKCNK3KCNK9NPC1POLB
SCHEMBL4324580 0.87 SLC2A1 (0.53) KDM4ESLC2A1HTTGABRB2
SCHEMBL8208 0.78 KDM4E (0.64) KDM4EKCNK3KCNK9GAASLC2A1
SCHEMBL2197080 0.78 SLC2A1 (0.52) KDM4ESLC2A1HTTGABRB2
SCHEMBL2196283 0.78 ALDH1A1 (0.55) KDM4ESLC2A1HTTGABRB2
SCHEMBL4463028 0.77 KCNK3 (0.55) KDM4EKCNK3KCNK9GAASLC2A1
SCHEMBL1433238 0.77 GABRA1 (0.56) KDM4EKCNK3KCNK9GAASLC2A1
SCHEMBL2179254 0.76 CYP1A2 (0.52) GAASLC2A1GABRB2

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-2009143156-A2 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS SEPRACOR INC. (US) 2009-11-26 — — WO disclosed
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