SCHEMBL28145165

SCHEMBL28145165

[CH2]CC1=NOC(COc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
GRM2 Q14416 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
ESR1 P03372 1/20 0.39
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HRH3 Q9Y5N1 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
SCHEMBL28144245 0.85 TAAR1 (0.43) TDP1ALDH1A1
SCHEMBL28843884 0.84 KCNA3 (0.41) TDP1ALDH1A1DRD4
SCHEMBL28145266 0.79 LMNA (0.45) TSHRLMNAHRH3DRD1
SCHEMBL28144148 0.77 MEN1 (0.37) MEN1KMT2A
SCHEMBL28292352 0.77 TDP1 (0.43) TDP1GRM2ALDH1A1MAPTTP53
SCHEMBL18935961 0.75 LMNA (0.50) TDP1GRM2ALDH1A1MAPTSMN1; SMN2
SCHEMBL28145201 0.74 SLC6A2 (0.43) CYP3A4DRD4
SCHEMBL28145178 0.71 MEN1 (0.40) TSHRLMNAMEN1KMT2A
SCHEMBL23544407 0.70 PTPN7 (0.48) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
Ethylene SCHEMBL20448583 0.70 TDP1 (0.92) TDP1GRM2ALDH1A1MAPTTP53

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
CN-106572659-A Noxious arthropod control agent containing amide compound 住友化学株式会社 2017-04-19 CN disclosed