SCHEMBL8395164

SCHEMBL8395164

CCN(C(=O)C=NOC)c1ccccc1COc1cccc(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.41
LMNA P02545 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
MAPT P10636 3/20 0.41
RAB9A P51151 2/20 0.41
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
RECQL P46063 1/20 0.36
TRPM8 Q7Z2W7 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
SLC1A5 Q15758 1/20 0.36
NPC1 O15118 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL8395408 0.93 CYP3A4 (0.43) CYP3A4LMNAMAPTTDP1RECQL
SCHEMBL8398724 0.89 NISCH (0.38) CYP3A4LMNAL3MBTL1MAPTTDP1
SCHEMBL8399135 0.88 CYP3A4 (0.43) CYP3A4LMNAMAPTTDP1MEN1
SCHEMBL8398841 0.87 L3MBTL1 (0.42) LMNAL3MBTL1MAPTRAB9AMAPK1
SCHEMBL9241220 0.86 RECQL (0.41) CYP3A4LMNAL3MBTL1MAPTRECQL
SCHEMBL8399060 0.85 TP53 (0.45) LMNAL3MBTL1MAPTRAB9ATDP1
SCHEMBL8399129 0.85 LMNA (0.41) CYP3A4LMNAL3MBTL1MAPTMAPK1
SCHEMBL8396234 0.85 PPARD (0.39) CYP3A4LMNASLC1A5
SCHEMBL8395678 0.84 MRGPRX4 (0.39) CYP3A4LMNAL3MBTL1MAPTRAB9A
SCHEMBL8398007 0.84 SMN1; SMN2 (0.39) CYP3A4LMNAL3MBTL1MAPTRAB9A

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