SCHEMBL7091759

SCHEMBL7091759

OC(Cc1cccnc1)c1c[nH]c2ccc(F)cc12

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF20A O95235 1/20 0.50
TDO2 P48775 3/20 0.47
CLK1 P49759 2/20 0.47
DYRK1A Q13627 2/20 0.47
IDO1 P14902 3/20 0.44
KCNH2 Q12809 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GPR84 Q9NQS5 2/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
GRM2 Q14416 1/20 0.40

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
SCHEMBL5726614 0.80 TDO2 (0.49) TDO2CLK1DYRK1AIDO1GPR84
SCHEMBL7091761 0.77 TDO2 (0.46) TDO2CLK1DYRK1AIDO1KCNH2
SCHEMBL5725721 0.77 GPR84 (0.63) TDO2CLK1DYRK1AGPR84HTR2A
SCHEMBL3220165 0.76 MPO (0.56) GPR84HTR2A
SCHEMBL17242222 0.74 HTR2A (0.54) KCNH2GPR84HTR2AHTR2C
SCHEMBL17242338 0.72 KCNH2 (0.48) KCNH2GPR84HTR2AHTR2C
SCHEMBL5726248 0.72 TDO2 (0.79) TDO2CLK1DYRK1A
SCHEMBL19192950 0.72 KIF20A (0.73) KIF20ACLK1DYRK1AIDO1ALDH1A1
SCHEMBL5727457 0.71 GPR84 (0.43) CLK1DYRK1AGPR84HTR2AHTR2C
SCHEMBL9651541 0.70 HTR2A (0.53) GPR84HTR2AHTR2C

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-1355900-A2 HETEROCYCLYLALKYLINDOLE OR -AZAINDOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth (US) 2003-10-29 EP disclosed
WO-2002051832-A2 HETEROCYCLYLALKYLINDOLE OR -AZAINDOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2002-07-04 WO disclosed