SCHEMBL7786604

SCHEMBL7786604

CCC(C)CCc1cc(Cl)ccc1NC(=O)c1cn(C)nc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
POLB P06746 1/20 0.57
GRM5 P41594 1/20 0.40
STING1 Q86WV6 1/20 0.40
KLKB1 P03952 3/20 0.39
NTRK1 P04629 1/20 0.38
BACE1 P56817 3/20 0.37
BACE2 Q9Y5Z0 3/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
GAA P10253 1/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
WDR5 P61964 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
SCHEMBL7790957 0.86 POLB (0.50) LMNAPOLBSTING1NTRK1SMN1; SMN2
SCHEMBL8411920 0.78 LMNA (0.60) LMNAPOLBSTING1KLKB1NTRK1
SCHEMBL12742819 0.77 LMNA (0.42) LMNAPOLBGRM5TP53MAPT
SCHEMBL1259947 0.77 LMNA (0.53) LMNAPOLBSTING1NTRK1GAA
SCHEMBL28345084 0.75 LMNA (0.61) LMNAPOLBSTING1TP53MAPT
SCHEMBL16618150 0.74 LMNA (0.63) LMNAPOLBNTRK1SMN1; SMN2NPSR1
SCHEMBL973103 0.73 LMNA (0.62) LMNAPOLBSTING1KDM4ENPSR1
SCHEMBL302846 0.73 LMNA (0.61) LMNAPOLBGRM5STING1NTRK1
SCHEMBL1136177 0.73 LMNA (0.64) LMNAPOLBSTING1NTRK1NPSR1
SCHEMBL302426 0.73 LMNA (0.64) LMNAPOLBGRM5STING1NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0824099-B1 Substituted carboxanilide derivative and plant disease control agent comprising same as active ingredient MITSUI CHEMICALS INC (JP) 2001-11-07 EP disclosed
US-5965774-A CONTROLLING PLANT DISEASES AGAINST BOTRYTIS CINEREA, POWDERY MILDEW, PYRICULARIA ORYZAE OF RICE PLANT MITSUI CHEMICALS, INC. (JP) 1999-10-12 US disclosed
US-5914344-A Substituted carboxanilide derivative and plant disease control agent comprising same as active ingredient MITSUI CHEMICALS, INC. (JP) 1999-06-22 US disclosed
EP-0824099-A1 Substituted carboxanilide derivative and plant disease control agent comprising same as active ingredient MITSUI TOATSU CHEMICALS, Inc. (JP) 1998-02-18 EP disclosed