SCHEMBL5752463

SCHEMBL5752463

Cc1ccc(F)c(-n2nnc(COc3nnc(-c4ccncc4)n3C)n2)c1.Cc1cccc(-n2nnc(C(C)Oc3nnc(-c4ccncc4)n3C)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.53
KCNH2 Q12809 2/20 0.41
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL5757547 0.88 GRM5 (0.41) GRM5KCNH2
SCHEMBL2895374 0.87 GRM5 (0.49) GRM5KCNH2MEN1ALDH1A1KMT2A
SCHEMBL2897330 0.85 MAPT (0.39) KCNH2MEN1ALDH1A1KMT2AMAPT
SCHEMBL2891488 0.85 GRM5 (0.69) GRM5KCNH2MEN1ALDH1A1KMT2A
SCHEMBL2895170 0.83 GRM5 (0.45) GRM5KCNH2MEN1ALDH1A1KMT2A
SCHEMBL2895291 0.78 GRM5 (0.73) GRM5KCNH2MEN1ALDH1A1KMT2A
SCHEMBL2895780 0.78 GRM5 (0.73) GRM5KCNH2MEN1ALDH1A1KMT2A
SCHEMBL2895294 0.78 GRM5 (0.73) GRM5KCNH2MEN1ALDH1A1KMT2A
SCHEMBL30795719 0.78 GRM5 (0.67) GRM5KCNH2
SCHEMBL1997502 0.78 GRM5 (0.67) GRM5KCNH2

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 disclosed
WO-2005080356-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS ASTRAZENECA AB (SE) 2005-09-01 WO disclosed