SCHEMBL8320679

SCHEMBL8320679

COC(=O)c1[nH]c2c(C)ccc(Cl)c2c1C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
HTT P42858 2/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
NR4A2 P43354 3/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
KMT2A Q03164 3/20 0.38
PTGS2 P35354 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MET P08581 2/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
ALOX5 P09917 1/20 0.36

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
SCHEMBL8319604 0.92 LMNA (0.40) LMNAHTTGAATSHRNR4A2
SCHEMBL8323663 0.92 NPSR1 (0.38) LMNAHTTGAATSHRNR4A2
SCHEMBL8320986 0.91 MAPT (0.46) LMNAHTTTSHRNPC1RAB9A
SCHEMBL8324480 0.88 NR4A2 (0.41) LMNAHTTGAATSHRNR4A2
SCHEMBL8319119 0.87 NR4A2 (0.38) LMNAHTTGAATSHRNR4A2
SCHEMBL8326080 0.80 CYP1A2 (0.40) LMNAHTTGAATSHRNR4A2
SCHEMBL8323510 0.80 HPGD (0.39) LMNATSHRNR4A2NPC1RAB9A
SCHEMBL8320947 0.80 LMNA (0.41) LMNAHTTGAANPC1RAB9A
SCHEMBL16098758 0.79 USP2 (0.44) LMNAHTTGAATSHRNR4A2
SCHEMBL8322152 0.79 LMNA (0.44) LMNAHTTGAATSHRNR4A2

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