SCHEMBL6929405

SCHEMBL6929405

COc1ccc2nc(Cl)c3ncn(CCC4CCNCC4)c3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GLA P06280 2/20 0.42
GAA P10253 2/20 0.42
HPGD P15428 1/20 0.42
DYRK3 O43781 1/20 0.40
CLK1 P49759 1/20 0.40
CLK2 P49760 1/20 0.40
CLK3 P49761 1/20 0.40
DYRK1A Q13627 1/20 0.40
DYRK2 Q92630 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
DYRK4 Q9NR20 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
NPY1R P25929 3/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
ACP1 P24666 2/20 0.38
TDP1 Q9NUW8 1/20 0.37
NCF1 P14598 1/20 0.37
FGFR1 P11362 2/20 0.37

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
SCHEMBL6926216 0.87 NR3C1 (0.38) KDM4EALDH1A1HPGDNPY1RIRAK4
SCHEMBL6929031 0.87 SLC6A4 (0.40) KDM4ENPY1RIRAK4ACP1NR3C1
SCHEMBL6925999 0.83 ACHE (0.43) NPY1RACP1NR3C1
SCHEMBL6924891 0.82 DYRK3 (0.40) DYRK3CLK1CLK2CLK3DYRK1A
SCHEMBL6928523 0.80 NPY1R (0.42) ALDH1A1DYRK3CLK1CLK2CLK3
Trifluoroacetic Acid SCHEMBL6928326 0.78 NR3C1 (0.45) NPY1RACP1NR3C1
SCHEMBL6923151 0.71 ACP1 (0.47) KDM4EALDH1A1GAAHPGDNPY1R
SCHEMBL6096772 0.70 TLR7 (0.56) NPY1R
Hydrochloric Acid SCHEMBL6929408 0.69 TLR7 (0.55) NPY1R
SCHEMBL6927830 0.69 ADRB2 (0.40) NPY1R

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
US-6518265-B1 1H-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2003-02-11 US disclosed
EP-1104764-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2001-06-06 EP disclosed