SCHEMBL7486170

SCHEMBL7486170

CN(C)C(=O)C1Cc2cc(F)ccc2NC1=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 2/20 0.38
DDB1 Q16531 3/20 0.36
CRBN Q96SW2 3/20 0.36
HDAC3 O15379 1/20 0.36
HTT P42858 1/20 0.35
ACHE P22303 1/20 0.33
KMT2A Q03164 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
KIF11 P52732 1/20 0.32
TP53 P04637 1/20 0.32
TGM2 P21980 1/20 0.32
MGAT2 Q10469 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
CASP3 P42574 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
SCHEMBL7837367 0.84 AHR (0.44) HTR5AHTT
SCHEMBL7483478 0.83 HTR5A (0.39) HTR5AHDAC3ACHEKMT2A
SCHEMBL7833042 0.82 PDE3B (0.47) DDB1CRBNACHEPDE3BPDE3A
SCHEMBL7836971 0.80 CREBBP (0.46) HTR5ADDB1CRBN
SCHEMBL7826445 0.76 CA9 (0.43) HTR5ADDB1CRBNKMT2A
SCHEMBL7825601 0.76 CMA1 (0.44) HTR5AHTT
SCHEMBL4622546 0.74 HTR5A (0.43) HTR5AACHEPDE3BPDE3A
SCHEMBL13878894 0.72 HTR5A (0.45) HTR5AHDAC3ACHEKMT2A
SCHEMBL31552579 0.72 HTR5A (0.45) HTR5AHDAC3ACHEKMT2A
Hydrochloric Acid SCHEMBL4072833 0.71 HTR5A (0.44) HTR5AHDAC3ACHEKMT2A

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
EP-1227090-A1 AMINE DERIVATIVES Tadeka Chemical Industries, Ltd. (JP) 2002-07-31 EP disclosed