SCHEMBL29818149

SCHEMBL29818149

COC(=O)c1ccnc(Nc2ccc(-c3ccccc3)cn2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.47
KDM4E B2RXH2 1/20 0.47
KDM6B O15054 1/20 0.47
KDM5C P41229 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
KDM2A Q9Y2K7 1/20 0.47
KDM3A Q9Y4C1 1/20 0.47
AXL P30530 2/20 0.46
SGK1 O00141 1/20 0.46
CAMKK2 Q96RR4 1/20 0.46
CYP19A1 P11511 1/20 0.46
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
MAPT P10636 2/20 0.45
GSK3A P49840 1/20 0.45
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
EGFR P00533 1/20 0.44

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
SCHEMBL29818120 0.87 GSK3B (0.51) GSK3BKDM4EKDM6BKDM5CKDM4C
SCHEMBL29818088 0.86 KDM4E (0.48) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL3493205 0.83 NPC1 (0.52) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL29818053 0.82 MAPT (0.64) KDM4EAXLMAPTHPGDRAB9A
SCHEMBL3718393 0.77 KDM4E (0.68) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL30772302 0.77 KDM4E (0.68) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL16702299 0.74 MAPT (0.41) GSK3BKDM4EKDM6BKDM5CKDM4C
SCHEMBL581398 0.74 KDM4E (0.71) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL21867435 0.73 RAB9A (0.60) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL22575205 0.72 CYP19A1 (0.52) KDM4ECYP19A1CYP11B1CYP11B2MAPT

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-2022195522-A1 INHIBITORS OF ANO6 AND THEIR USES THEREOF ILDONG PHARMACEUTICAL CO., LTD. (KR) 2022-09-22 WO disclosed
WO-2022157686-A1 INHIBITORS OF ANOCTAMIN 6 PROTEIN AND USES THEREOF ILDONG PHARMACEUTICAL CO., LTD. (KR) 2022-07-28 WO disclosed