SCHEMBL8399045

SCHEMBL8399045

CNC(=O)/C(=N/OC)c1ccccc1COc1cc(C)cc(C)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.57
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
TP53 P04637 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL8372645 1.00 HIF1A (0.57) HIF1AKDM4EALDH1A1MAPTHPGD
SCHEMBL8372646 1.00 HIF1A (0.57) HIF1AKDM4EALDH1A1MAPTHPGD
SCHEMBL8396304 0.91 HIF1A (0.64) HIF1AALDH1A1MAPTMEN1KMT2A
SCHEMBL8371621 0.91 HIF1A (0.64) HIF1AALDH1A1MAPTMEN1KMT2A
SCHEMBL8371619 0.91 HIF1A (0.64) HIF1AALDH1A1MAPTMEN1KMT2A
SCHEMBL8096251 0.89 HIF1A (0.56) HIF1AALDH1A1MAPTHPGDHTT
SCHEMBL8369944 0.89 HIF1A (0.56) HIF1AALDH1A1MAPTHPGDHTT
SCHEMBL8096246 0.89 HIF1A (0.56) HIF1AALDH1A1MAPTHPGDHTT
SCHEMBL8400203 0.89 HIF1A (0.55) HIF1AKDM4EALDH1A1MAPTHPGD
SCHEMBL8400211 0.89 HIF1A (0.55) HIF1AKDM4EALDH1A1MAPTHPGD

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