SCHEMBL22304658

SCHEMBL22304658

NN1CC(c2cccc(C(F)(F)F)c2)C(C(=O)N(N)c2cccc(F)c2F)C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 3/20 0.36
▸ HTR2A P28223 2/20 0.36
▸ HTR2C P28335 2/20 0.36
▸ HTR7 P34969 1/20 0.35
▸ GUSB P08236 1/20 0.34
▸ KIF11 P52732 1/20 0.34
▸ RPS6KB1 P23443 1/20 0.34
▸ AKT1 P31749 1/20 0.34
▸ LMNA P02545 3/20 0.33
▸ TSHR P16473 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CHRM2 P08172 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ DRD3 P35462 1/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ RCOR1 Q9UKL0 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32

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
SCHEMBL23642556 0.82 HRH3 (0.36) —
SCHEMBL22304657 0.80 POLQ (0.37) HTR2BHTR7GUSBKIF11LMNA
SCHEMBL23911984 0.79 ROCK2 (0.39) HTR2BHTR2AHTR2CGUSBTSHR
SCHEMBL23642424 0.78 RBP4 (0.38) HTR2BHTR2AHTR2CHTR7GUSB
SCHEMBL23911983 0.76 PTGIR (0.35) KIF11LMNAALDH1A1KMT2A
SCHEMBL25317840 0.75 HTR2B (0.38) HTR2BHTR2AHTR2CHTR7GUSB
SCHEMBL27251508 0.72 CCKAR (0.36) MEN1KMT2A
SCHEMBL25313489 0.72 RPS6KB1 (0.38) HTR2BHTR2AHTR2CHTR7GUSB
SCHEMBL25895244 0.72 — —
SCHEMBL25319499 0.71 ALDH1A1 (0.40) HTR2BHTR2AHTR2CGUSBRPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020160202-A1 DIAMINO-SUBSTITUTED PYRIDINES AND PYRIMIDINES AS HERBICIDES FMC CORPORATION (US) 2020-08-06 — — WO disclosed
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