SCHEMBL8192518

SCHEMBL8192518

CCCCOC(=O)NC(Cl)c1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.46
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 7/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK1 P28482 1/20 0.43
CTSK P43235 2/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2C19 P33261 2/20 0.42
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 1/20 0.42
NFKB1 P19838 1/20 0.42
STAT1 P42224 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42

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
SCHEMBL8203981 0.85 L3MBTL1 (0.46) L3MBTL1GAASMN1; SMN2MEN1KMT2A
SCHEMBL5086318 0.81 FAAH (0.45) L3MBTL1GAASMN1; SMN2MEN1KMT2A
SCHEMBL8200988 0.80 GAA (0.46) L3MBTL1GAASMN1; SMN2MEN1KMT2A
SCHEMBL11027264 0.77 GAA (0.48) L3MBTL1GAASMN1; SMN2MEN1KMT2A
SCHEMBL8803475 0.76 SMN1; SMN2 (0.48) L3MBTL1SMN1; SMN2MAPK1CTSKCYP1A2
SCHEMBL8213597 0.76 GAA (0.43) L3MBTL1GAASMN1; SMN2MEN1KMT2A
SCHEMBL1921112 0.74 SMN1; SMN2 (0.59) L3MBTL1GAASMN1; SMN2CTSKCYP1A2
SCHEMBL6122738 0.74 HPGD (0.47) L3MBTL1GAASMN1; SMN2MAPK1CTSK
SCHEMBL5086307 0.74 HDAC6 (0.49) CTSKHPGDHSD17B10
SCHEMBL6440708 0.74 GAA (0.45) L3MBTL1GAASMN1; SMN2MEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2000169449-A NEW PRODUCTION INTERMEDIATE FOR FLUORINE-CONTAINING 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVE BANYU PHARMACEUT CO LTD 2000-06-20 JP disclosed