SCHEMBL7099342

SCHEMBL7099342

C=CC(=O)NC1CCc2[nH]cnc2C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 8/20 0.39
JAK2 O60674 7/20 0.38
JAK1 P23458 7/20 0.38
SMYD3 Q9H7B4 1/20 0.36
TEAD1 P28347 2/20 0.34
BTK Q06187 2/20 0.34
ADRA1A P35348 1/20 0.33

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
SCHEMBL6846977 0.78 POLB (0.50)
SCHEMBL6846975 0.78 POLB (0.50)
SCHEMBL7094424 0.76 MTNR1A (0.49) SMYD3BTKADRA1A
SCHEMBL6850768 0.74 MEN1 (0.44) ADRA1A
SCHEMBL6850893 0.74 KMT2A (0.49)
SCHEMBL6849668 0.73 HPGD (0.51)
SCHEMBL6851228 0.72 EPHX1 (0.44)
SCHEMBL13531413 0.71 HTR3A (0.42) ADRA1A
SCHEMBL13531389 0.71 HTR3A (0.42) ADRA1A
SCHEMBL9617115 0.70 EPHX2 (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268484-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2003-01-02 EP disclosed
WO-2001068652-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2001-09-20 WO disclosed