SCHEMBL8624613

SCHEMBL8624613

CO/C=C(/C(=O)OC)c1ccccc1CO/N=C(/C)c1nn(C)c2cc(OCc3ccc(F)cc3)c(F)cc12

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
AGTR1 P30556 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 3/20 0.34
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
HIF1A Q16665 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
SCHEMBL8622190 0.86 HIF1A (0.33) MEN1KMT2AALDH1A1SMN1; SMN2HIF1A
SCHEMBL8624045 0.86
SCHEMBL8624994 0.81 KDM4E (0.40) ALDH1A1MAPK1HIF1A
SCHEMBL8624971 0.77 HIF1A (0.36) L3MBTL1SMN1; SMN2HIF1A
SCHEMBL5257827 0.77 HIF1A (0.36) L3MBTL1SMN1; SMN2HIF1A
SCHEMBL9055753 0.71 HIF1A (0.42) HIF1A
SCHEMBL8772917 0.71 HIF1A (0.42) HIF1A
SCHEMBL9056021 0.71 HIF1A (0.38) HIF1A
SCHEMBL18292032 0.70 HIF1A (0.39) LMNAALDH1A1HIF1A
SCHEMBL7467513 0.69 MAOB (0.41) PLA2G1BATG4BMEN1KMT2ALMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0844993-A2 PESTICIDAL INDAZOLE DERIVATIVES Novartis AG (CH) 1998-06-03 EP claimed
WO-1997007103-A2 PESTICIDAL INDAZOLE DERIVATIVES NOVARTIS AG (CH) 1997-02-27 WO claimed
EP-0844993-A2 PESTICIDAL INDAZOLE DERIVATIVES Novartis AG (CH) 1998-06-03 EP disclosed
WO-1997007103-A2 PESTICIDAL INDAZOLE DERIVATIVES NOVARTIS AG (CH) 1997-02-27 WO disclosed