SCHEMBL27640373

SCHEMBL27640373

O=CC1NC=NN1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.36
▸ GSK3A P49840 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ PRKCZ Q05513 2/20 0.33
▸ TRPV1 Q8NER1 1/20 0.33
▸ ATM Q13315 1/20 0.32
▸ NOTUM Q6P988 2/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ ITGA4 P13612 1/20 0.32
▸ ITGB7 P26010 1/20 0.32
▸ HIF1A Q16665 1/20 0.31
▸ CA2 P00918 2/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ HDAC3 O15379 1/20 0.30
▸ ADAM17 P78536 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC10 Q969S8 1/20 0.30
▸ HDAC11 Q96DB2 1/20 0.30

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
SCHEMBL27640369 0.83 HTT (0.44) TDP1PRKCZNOTUMPTGS2
SCHEMBL27621423 0.83 MGLL (0.35) —
SCHEMBL27448230 0.80 MGLL (0.35) PRKCZITGA4ITGB7
SCHEMBL27418186 0.79 ALDH1A1 (0.33) GSK3AGSK3BATM
SCHEMBL27621579 0.77 PRKCZ (0.36) TDP1GSK3AGSK3BPRKCZTRPV1
SCHEMBL27621556 0.76 TDP1 (0.36) TDP1GSK3AGSK3BPRKCZTRPV1
SCHEMBL27640364 0.74 MAPT (0.38) TDP1TRPV1
SCHEMBL27640321 0.72 FAAH (0.41) PRKCZADORA3
SCHEMBL27640481 0.71 TDP1 (0.36) TDP1GSK3AGSK3BTRPV1ATM
SCHEMBL27640315 0.71 TDP1 (0.40) TDP1GSK3AGSK3BTRPV1ATM

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
CN-100522952-C Insecticidal phthalamide derivatives BAYER CROPSCIENCE AG (DE) 2009-08-05 — — CN disclosed
CN-1980903-A Substituted cyclic urea derivatives BAYER CROPSCIENCE AG (DE) 2007-06-13 — — CN disclosed
CN-1759105-A Phthalamide derivatives having insecticidal activity BAYER CROPSCIENCE AG (DE) 2006-04-12 — — CN disclosed
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