SCHEMBL8320947

SCHEMBL8320947

COC(=O)c1[nH]c2c(C)ccc(Cl)c2c1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
FBP1 P09467 1/20 0.38
KMT2A Q03164 6/20 0.37
MEN1 O00255 5/20 0.37
MAPT P10636 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 3/20 0.36
GAA P10253 1/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KDM4E B2RXH2 1/20 0.35
DCTPP1 Q9H773 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
SCHEMBL8319814 0.89 MAPT (0.42) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL8319119 0.81 NR4A2 (0.38) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL8320679 0.80 LMNA (0.42) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL8323663 0.77 NPSR1 (0.38) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL8326080 0.75 CYP1A2 (0.40) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL8319604 0.75 LMNA (0.40) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL8323510 0.74 HPGD (0.39) LMNAFBP1KMT2AMEN1MAPT
SCHEMBL8318820 0.72 NR4A2 (0.40) LMNAKMT2AMAPTSMN1; SMN2HTT
SCHEMBL8320986 0.72 MAPT (0.46) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL8318534 0.70 KDM4E (0.46) KMT2AMEN1MAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5866594-A Indole-2-carboxylate derivatives and fungicidal compositions for agricultural or horticultural use containing the derivatives as active component OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1999-02-02 US disclosed
EP-0791582-A1 INDOLE-2-CARBOXYLIC ESTER DERIVATIVES AND AGRICULTURAL AND HORTICULTURAL BACTERIOCIDES CONTAINING THE SAME AS THE ACTIVE INGREDIENT OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-08-27 EP disclosed