SCHEMBL30193643

SCHEMBL30193643

Cc1ncc2[nH]c(=O)n(-c3ccc(Oc4cccc(OC(F)(F)F)c4)nc3)c2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.38
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
EGLN1 Q9GZT9 1/20 0.37
MAPK1 P28482 1/20 0.36
F10 P00742 1/20 0.34
KCNH2 Q12809 2/20 0.34
SCN10A Q9Y5Y9 2/20 0.34
ALDH1A1 P00352 2/20 0.34
SCN7A Q01118 1/20 0.34
SCN9A Q15858 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
XDH P47989 1/20 0.33
OPRM1 P35372 1/20 0.33
PIM1 P11309 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
BRCA1 P38398 1/20 0.33

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
SCHEMBL25027695 1.00 LIPE (0.38) LIPEPOLBL3MBTL1EGLN1MAPK1
SCHEMBL25027486 0.89 ALDH1A1 (0.45) EGLN1MAPK1ALDH1A1XDHKDM4E
SCHEMBL30794004 0.89 ALDH1A1 (0.45) EGLN1MAPK1ALDH1A1XDHKDM4E
SCHEMBL30793990 0.87 POLB (0.37) POLBL3MBTL1KCNH2SCN10ASCN7A
SCHEMBL25027489 0.87 POLB (0.37) POLBL3MBTL1KCNH2SCN10ASCN7A
SCHEMBL25027700 0.84 LIPE (0.38) LIPEPOLBL3MBTL1EGLN1MAPK1
SCHEMBL30794039 0.84 LIPE (0.38) LIPEPOLBL3MBTL1EGLN1MAPK1
SCHEMBL25027896 0.79 MAT2A (0.39) LIPEPOLBL3MBTL1EGLN1MAPK1
SCHEMBL23927021 0.75 POLB (0.35) POLBL3MBTL1KCNH2SCN10AALDH1A1
SCHEMBL25025657 0.75 DRD1 (0.41) POLBL3MBTL1

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-117751119-A Potassium channel modulators 奥蒂福尼疗法有限公司 2024-03-22 CN claimed
CN-117751119-A Potassium channel modulators 奥蒂福尼疗法有限公司 2024-03-22 CN disclosed
WO-2023017263-A1 POTASSIUM CHANNEL MODULATORS AUTIFONY THERAPEUTICS LIMITED (GB) 2023-02-16 WO disclosed