SCHEMBL31436639

SCHEMBL31436639

COc1c(Cl)c(F)c(F)c(F)c1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
GRIN2D O15399 4/20 0.38
GRIN3B O60391 4/20 0.38
GRIN1 Q05586 4/20 0.38
GRIN2A Q12879 4/20 0.38
GRIN2B Q13224 4/20 0.38
GRIN2C Q14957 4/20 0.38
GRIN3A Q8TCU5 4/20 0.38
TSHR P16473 3/20 0.35
TDP1 Q9NUW8 3/20 0.35
ALDH1A1 P00352 3/20 0.35
PKM P14618 2/20 0.35
MAPT P10636 4/20 0.34
KDM4E B2RXH2 3/20 0.34
BLM P54132 1/20 0.34
IMPDH2 P12268 1/20 0.34
POLB P06746 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MCL1 Q07820 1/20 0.31

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
SCHEMBL30695143 0.79 SMN1; SMN2 (0.43) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7970186 0.79 SMN1; SMN2 (0.43) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28694251 0.78 SMN1; SMN2 (0.46) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6832945 0.78 SMN1; SMN2 (0.46) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28695104 0.78 SMN1; SMN2 (0.46) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8086687 0.78 TSHR (0.44) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL10977727 0.76 SMN1; SMN2 (0.44) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4603550 0.76 TSHR (0.43) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28525347 0.75 TSHR (0.46) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4814058 0.75 TSHR (0.39) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A

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-119677410-A Herbicidal compositions comprising azine compounds 巴斯夫欧洲公司 2025-03-21 CN disclosed