SCHEMBL8399093

SCHEMBL8399093

CCNC(=O)C(=NOC)c1ccccc1COc1cccc(F)c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.62
MRGPRX4 Q96LA9 1/20 0.45
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
HTR1A P08908 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HTR6 P50406 1/20 0.39
MAOB P27338 1/20 0.39
GPR34 Q9UPC5 1/20 0.38
PARP15 Q460N3 1/20 0.38
PARP10 Q53GL7 1/20 0.38

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
SCHEMBL8399089 1.00 HIF1A (0.62) HIF1AMRGPRX4SLC6A2SLC6A4HTR1A
SCHEMBL8395953 0.89 HIF1A (0.62) HIF1A
SCHEMBL8395957 0.89 HIF1A (0.62) HIF1A
SCHEMBL8398990 0.89 HIF1A (0.53) HIF1AMAOBPARP10
SCHEMBL8398999 0.89 HIF1A (0.53) HIF1AMAOBPARP10
SCHEMBL8399228 0.89 HIF1A (0.64) HIF1AMRGPRX4SLC6A2SLC6A4HTR1A
SCHEMBL8399234 0.89 HIF1A (0.64) HIF1AMRGPRX4SLC6A2SLC6A4HTR1A
SCHEMBL8621332 0.89 HIF1A (0.60) HIF1A
SCHEMBL8621337 0.89 HIF1A (0.60) HIF1A
SCHEMBL8396217 0.88 HIF1A (0.65) HIF1AMRGPRX4MAOB

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
EP-0644183-B1 Process of producing N-alkylacetamides SHIONOGI & CO (JP) 1999-06-02 EP disclosed
US-5498792-A Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1996-03-12 US disclosed