SCHEMBL8903104

SCHEMBL8903104

CCN(C(=O)n1nnn(-c2ccccc2)c1=O)C1CCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
ALDH1A1 P00352 3/20 0.46
GAA P10253 1/20 0.46
SLC6A9 P48067 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
FPR1 P21462 1/20 0.42
TRPV1 Q8NER1 2/20 0.41
HSD11B1 P28845 1/20 0.41
ATM Q13315 2/20 0.40
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RAB9A P51151 1/20 0.39
TRPA1 O75762 1/20 0.39
MGLL Q99685 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL12115670 1.00 L3MBTL1 (0.48) L3MBTL1ALDH1A1GAASLC6A9SLC6A2
SCHEMBL12115705 0.90 TP53 (0.41) L3MBTL1ALDH1A1GAAATMMEN1
SCHEMBL12115717 0.89 ALDH1A1 (0.40) L3MBTL1ALDH1A1GAAHSD11B1ATM
SCHEMBL12115712 0.89 TSHR (0.43) L3MBTL1ALDH1A1ATMMEN1KMT2A
SCHEMBL12115718 0.88 LMNA (0.46) L3MBTL1ALDH1A1SLC6A9HSD11B1LMNA
SCHEMBL12115723 0.88 MAPT (0.40) L3MBTL1ALDH1A1ATMMEN1KMT2A
SCHEMBL12178176 0.88 L3MBTL1 (0.38) L3MBTL1ALDH1A1GAATRPV1HSD11B1
SCHEMBL8902194 0.87 L3MBTL1 (0.44) L3MBTL1ALDH1A1GAASLC6A9SLC6A2
SCHEMBL12115715 0.87 KMT2A (0.40) L3MBTL1ALDH1A1GAATRPV1ATM
SCHEMBL12118942 0.87 HSD11B1 (0.45) L3MBTL1ALDH1A1HSD11B1ATMMEN1

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
US-5652198-A Herbicidally active tetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1997-07-29 US claimed