SCHEMBL8396138

SCHEMBL8396138

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

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.54
MCL1 Q07820 1/20 0.46
IGF1R P08069 1/20 0.42
MET P08581 1/20 0.42
SRC P12931 1/20 0.42
DDR1 Q08345 1/20 0.41
MRGPRX4 Q96LA9 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL8396132 1.00 HIF1A (0.54) HIF1AMCL1IGF1RMETSRC
SCHEMBL8620469 0.91 HIF1A (0.55) HIF1AMCL1IGF1RMETSRC
SCHEMBL8396217 0.91 HIF1A (0.65) HIF1AMCL1IGF1RMETSRC
SCHEMBL8396210 0.91 HIF1A (0.65) HIF1AMCL1IGF1RMETSRC
SCHEMBL8620470 0.91 HIF1A (0.55) HIF1AMCL1IGF1RMETSRC
SCHEMBL8621920 0.88 HIF1A (0.55) HIF1AMCL1DDR1MRGPRX4L3MBTL1
SCHEMBL8621917 0.88 HIF1A (0.55) HIF1AMCL1DDR1MRGPRX4L3MBTL1
SCHEMBL8617459 0.87 HIF1A (0.54) HIF1AMCL1DDR1MRGPRX4L3MBTL1
SCHEMBL8617460 0.87 HIF1A (0.54) HIF1AMCL1DDR1MRGPRX4L3MBTL1
SCHEMBL8624032 0.86 HIF1A (0.48) HIF1AKDM4E

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 6 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
EP-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
US-5498792-A Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1996-03-12 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed
EP-0644183-A2 Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1995-03-22 EP disclosed