SCHEMBL7466206

SCHEMBL7466206

CCON=C(C(C)=C(ON)c1ccccc1C(=NOC)C(=O)NC)c1ccc(Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HIF1A Q16665 1/20 0.33
BACE1 P56817 2/20 0.33
LTA4H P09960 1/20 0.31
EPHX2 P34913 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
LMNA P02545 1/20 0.31
MAOB P27338 2/20 0.31
RXFP1 Q9HBX9 1/20 0.30
CYP1A1 P04798 1/20 0.30
CYP1B1 Q16678 1/20 0.30
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30

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
SCHEMBL8544631 0.93 MAPK14 (0.37) MAPK14HIF1ALTA4HMAOBRXFP1
SCHEMBL7467428 0.91 MAOB (0.43) HIF1APPARGPPARAMAOB
SCHEMBL7464106 0.90 HIF1A (0.35) MEN1KMT2AHIF1A
SCHEMBL7470381 0.87 HTR2A (0.34) KMT2AHIF1AFNTAFNTB
SCHEMBL7494028 0.87 MAPK14 (0.39) MAPK14HIF1ALTA4HRXFP1
SCHEMBL7467539 0.85 MAOB (0.46) KMT2AHIF1AMAOB
SCHEMBL7470568 0.83 MAPK14 (0.38) MAPK14MEN1KMT2AHIF1ABACE1
SCHEMBL8540309 0.82 ALDH1A1 (0.36) MAPK14MEN1KMT2AEPHX2LMNA
SCHEMBL7492706 0.82 HIF1A (0.42) MAPK14MEN1KMT2AHIF1ABACE1
SCHEMBL6697613 0.82 MEN1 (0.38) MAPK14MEN1KMT2ABACE1LTA4H

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
EP-0865424-B1 PESTICIDES BAYER AG (DE) 2002-09-18 EP disclosed
EP-0865424-A1 PESTICIDES Novartis AG (CH) 1998-09-23 EP disclosed
WO-1997020809-A1 PESTICIDES NOVARTIS AG (CH) 1997-06-12 WO disclosed