SCHEMBL14022576

SCHEMBL14022576

COc1cc(-c2nc3cccc(C)n3c2Nc2ccc(Cl)c(Cl)c2)cc(F)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 16/20 0.54
▸ MAPT P10636 14/20 0.54
▸ TUBB4A P04350 1/20 0.54
▸ TUBB P07437 1/20 0.54
▸ TUBA3C P0DPH7 1/20 0.54
▸ TUBA1B P68363 1/20 0.54
▸ TUBA4A P68366 1/20 0.54
▸ TUBB4B P68371 1/20 0.54
▸ TUBB3 Q13509 1/20 0.54
▸ TUBB2A Q13885 1/20 0.54
▸ TUBB8 Q3ZCM7 1/20 0.54
▸ TUBA3E Q6PEY2 1/20 0.54
▸ TUBA1A Q71U36 1/20 0.54
▸ TUBA1C Q9BQE3 1/20 0.54
▸ TUBB6 Q9BUF5 1/20 0.54
▸ TUBB2B Q9BVA1 1/20 0.54
▸ TUBB1 Q9H4B7 1/20 0.54
▸ TP53 P04637 9/20 0.49
▸ PKLR P30613 3/20 0.49
▸ PKM P14618 2/20 0.49

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
SCHEMBL14022580 0.91 GAA (0.56) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL14022548 0.90 GAA (0.55) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL14022627 0.89 TUBB4A (0.66) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL2252820 0.84 GAA (0.69) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL2250661 0.84 GAA (0.77) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL14022622 0.82 TUBB4A (0.53) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL14022640 0.82 MAPT (0.65) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL14022545 0.79 MAPT (0.51) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL14022539 0.75 TUBB4A (0.55) GAAMAPTTUBB4ATUBBTUBA3C
SCHEMBL14022620 0.75 TUBB4A (0.62) GAAMAPTTUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008141239-A1 IMIDAZOL [1,2-A] PYRIDINES AND RELATED COMPOUNDS WITH ACTIVITY AT CANNABINOID CB2 RECEPTORS ACADIA PHARMACEUTICALS INC. (US) 2008-11-20 — — WO disclosed
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