SCHEMBL7790945

SCHEMBL7790945

C/C(=C\C(C)C)c1ccccc1NC(=O)c1cn(C)nc1C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
POLB P06746 1/20 0.53
ATM Q13315 1/20 0.44
STING1 Q86WV6 1/20 0.43
NTRK1 P04629 1/20 0.42
GAA P10253 1/20 0.41
IRAK4 Q9NWZ3 7/20 0.40
DHODH Q02127 1/20 0.39

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
SCHEMBL7790947 1.00 LMNA (0.53) LMNAPOLBATMSTING1NTRK1
SCHEMBL647508 0.84 ATM (0.47) LMNAPOLBATMGAA
SCHEMBL647509 0.84 ATM (0.47) LMNAPOLBATMGAA
SCHEMBL5634318 0.83 LMNA (0.49) LMNAPOLBSTING1NTRK1GAA
SCHEMBL5634321 0.83 LMNA (0.49) LMNAPOLBSTING1NTRK1GAA
SCHEMBL9262427 0.82 LMNA (0.57) LMNAPOLBATMSTING1NTRK1
SCHEMBL7790952 0.82 LMNA (0.52) LMNAPOLBATMSTING1NTRK1
SCHEMBL12393702 0.80 LMNA (0.60) LMNAPOLBATMSTING1NTRK1
SCHEMBL5357036 0.80 LMNA (0.60) LMNAPOLBATMSTING1NTRK1
SCHEMBL8784706 0.80 POLB (0.52) LMNAPOLBATMSTING1GAA

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 3 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
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