SCHEMBL5740467

SCHEMBL5740467

CCN1CCN(Cc2nnn(-c3cccc(Cl)c3)n2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.41
GAA P10253 1/20 0.41
KDM4E B2RXH2 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
HTR2A P28223 1/20 0.40
HTR7 P34969 1/20 0.40
HTR6 P50406 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KCNH2 Q12809 1/20 0.40
KDM2B Q8NHM5 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
SCHEMBL2898193 0.84 KCNH2 (0.53) DRD4KDM4EDRD2ALDH1A1KCNH2
SCHEMBL27648714 0.84 HTR1A (0.46) KDM4EHTR1AHTR7ALDH1A1
SCHEMBL3107655 0.81 GRM5 (0.47) GAALMNAALDH1A1
SCHEMBL2895891 0.77 NOTUM (0.54) GAALMNAALDH1A1
SCHEMBL2895023 0.76 GRM5 (0.44) GAALMNAALDH1A1
SCHEMBL2897512 0.74 DPP4 (0.49) KDM4ELMNAALDH1A1KCNH2
SCHEMBL5739242 0.74 MAPK1 (0.48) DRD4KDM4EOPRM1SIGMAR1LMNA
SCHEMBL10294634 0.73 KCNH2 (0.69) SIGMAR1KCNH2
SCHEMBL5739257 0.73 GRM5 (0.42) GAALMNAALDH1A1
SCHEMBL3955492 0.73 GRM5 (0.42) GAALMNAALDH1A1

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-1716125-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS AstraZeneca AB (SE) 2006-11-02 EP claimed
WO-2005080356-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS ASTRAZENECA AB (SE) 2005-09-01 WO claimed