SCHEMBL8400229

SCHEMBL8400229

CNC(=O)C(=NOC)c1ccccc1COc1ccccc1C(C)C

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.47
L3MBTL1 Q9Y468 1/20 0.40
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 2/20 0.38
HTR7 P34969 2/20 0.38
LMNA P02545 1/20 0.38
KCNK3 O14649 1/20 0.37
KCNK9 Q9NPC2 1/20 0.37
MEN1 O00255 1/20 0.37
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL8400225 1.00 HIF1A (0.47) HIF1AL3MBTL1TP53HTTKMT2A
SCHEMBL8617393 0.90 HIF1A (0.45) HIF1AL3MBTL1TP53HTTLMNA
SCHEMBL8617396 0.90 HIF1A (0.45) HIF1AL3MBTL1TP53HTTLMNA
SCHEMBL8519935 0.89 HIF1A (0.46) HIF1AL3MBTL1TP53HTTKMT2A
SCHEMBL8519937 0.89 HIF1A (0.46) HIF1AL3MBTL1TP53HTTKMT2A
SCHEMBL8624164 0.89 HIF1A (0.47) HIF1AL3MBTL1TP53HTTKMT2A
SCHEMBL8624160 0.89 HIF1A (0.47) HIF1AL3MBTL1TP53HTTKMT2A
SCHEMBL8624002 0.87 HIF1A (0.48) HIF1AL3MBTL1TP53HTTKMT2A
SCHEMBL8623999 0.87 HIF1A (0.48) HIF1AL3MBTL1TP53HTTKMT2A
SCHEMBL8371703 0.87 HIF1A (0.47) HIF1ATP53HTTLMNAALDH1A1

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 8 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
CN-1036580-C Process of producing N-alkylacetamides SHIONOGI & CO (JP) 1997-12-03 CN 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
CN-1105356-A Process of producing N-alkylacetamides SHIONOGI & CO (JP) 1995-07-19 CN 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