SCHEMBL9812593

SCHEMBL9812593

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(F)c2C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 7/20 0.69
ANPEP P15144 6/20 0.69
NR1H2 P55055 1/20 0.56
NR1H3 Q13133 1/20 0.56
GRM1 Q13255 3/20 0.42
GRM4 Q14833 2/20 0.42
GRM7 Q14831 1/20 0.42
ALPL P05186 1/20 0.41
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 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
SCHEMBL11016604 0.83 DPP4 (0.71) DPP4ANPEPNR1H2NR1H3
SCHEMBL11018078 0.83 DPP4 (0.71) DPP4ANPEPNR1H2NR1H3
SCHEMBL17531030 0.82 DPP4 (0.58) DPP4ANPEPNR1H2NR1H3
SCHEMBL2820118 0.82 DPP4 (0.78) DPP4ANPEPNR1H2NR1H3
SCHEMBL29366407 0.82 DPP4 (0.78) DPP4ANPEPNR1H2NR1H3
SCHEMBL11018214 0.82 DPP4 (0.74) DPP4ANPEPNR1H2NR1H3
SCHEMBL11018727 0.82 DPP4 (0.69) DPP4ANPEPNR1H2NR1H3GRM1
SCHEMBL17531035 0.81 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3
SCHEMBL2481189 0.81 DPP4 (0.80) DPP4ANPEPNR1H2NR1H3
SCHEMBL17531038 0.80 DPP4 (0.68) DPP4ANPEPNR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0245989-B1 FLUOROPHTHALIMIDES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-07-10 EP claimed
US-4839378-A FOR CONTROLLING PLANT DISEASES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1989-06-13 US claimed
EP-0245989-A2 Fluorophthalimides MEIJI SEIKA KABUSHIKI KAISHA (JP) 1987-11-19 EP claimed
EP-0245989-B1 FLUOROPHTHALIMIDES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-07-10 EP disclosed
US-4839378-A FOR CONTROLLING PLANT DISEASES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1989-06-13 US disclosed
EP-0245989-A2 Fluorophthalimides MEIJI SEIKA KABUSHIKI KAISHA (JP) 1987-11-19 EP disclosed