SCHEMBL8645609

SCHEMBL8645609

CNC(=O)C(=NOC)c1ccccc1COc1ccc(C(F)(F)F)c(NC)n1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.44
MAOB P27338 2/20 0.33
SGMS2 Q8NHU3 1/20 0.33
MAOA P21397 1/20 0.33
PTK2 Q05397 1/20 0.33
LRRK2 Q5S007 2/20 0.32
RBP4 P02753 1/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KMT2A Q03164 1/20 0.32
FLT4 P35916 1/20 0.32

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
SCHEMBL8645605 1.00 HIF1A (0.44) HIF1AMAOBSGMS2MAOAPTK2
SCHEMBL8371571 0.89 HIF1A (0.44) HIF1AMAOBSGMS2MAOAPTK2
SCHEMBL8371570 0.89 HIF1A (0.44) HIF1AMAOBSGMS2MAOAPTK2
SCHEMBL8368476 0.89 HIF1A (0.44) HIF1AMAOBSGMS2MAOAPTK2
SCHEMBL8780136 0.89 HIF1A (0.44) HIF1AMAOBSGMS2MAOAPTK2
SCHEMBL8368479 0.89 HIF1A (0.44) HIF1AMAOBSGMS2MAOAPTK2
SCHEMBL8372644 0.87 HIF1A (0.43) HIF1AMAOBSGMS2MAOARBP4
SCHEMBL8372643 0.87 HIF1A (0.43) HIF1AMAOBSGMS2MAOARBP4
SCHEMBL8369594 0.85 HIF1A (0.42) HIF1AMAOBSGMS2MAOARBP4
SCHEMBL8369593 0.85 HIF1A (0.42) HIF1AMAOBSGMS2MAOARBP4

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
US-5770614-A EXCELLENT ACTIVITY OF CONTROLLING PSEUDOCERCOSPORELLA HERPOTRICHOIDES SHIONOGI & CO., LTD. (JP) 1998-06-23 US disclosed