SCHEMBL8399047

SCHEMBL8399047

CON=CC(=O)N(C)c1ccccc1COc1cc(C)cc(C)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.39
HIF1A Q16665 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
F2 P00734 1/20 0.35
LMNA P02545 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
MAOB P27338 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL8396306 0.91 HIF1A (0.42) HIF1ASMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL8400501 0.90 FFAR1 (0.40) HIF1ALMNAKDM4EALDH1A1MAPT
SCHEMBL8400207 0.87 CYP3A4 (0.38) GRM5HIF1ASMN1; SMN2F2LMNA
SCHEMBL8397983 0.87 TDP1 (0.41) HIF1ASMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL8846363 0.84 PTGER4 (0.42) LMNAALDH1A1MAPT
SCHEMBL8399075 0.84 KMT2A (0.42) LMNAKDM4EALDH1A1MAOB
SCHEMBL8399059 0.84 SMN1; SMN2 (0.40) SMN1; SMN2LMNAALDH1A1MAPTHTT
SCHEMBL8399231 0.84 HIF1A (0.44) HIF1AMAOB
SCHEMBL896797 0.84 SMN1; SMN2 (0.40) SMN1; SMN2LMNAALDH1A1MAPTHTT
SCHEMBL8397935 0.84 MRGPRX4 (0.41) HIF1ASMN1; SMN2LMNAMAPTHPGD

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 3 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
EP-0644183-A2 Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1995-03-22 EP disclosed