SCHEMBL12811751

SCHEMBL12811751

COc1cc(CCNc2ncnc3nccnc23)ccc1Oc1cc(N)ccn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ HTT P42858 4/20 0.51
▸ TSHR P16473 4/20 0.51
▸ LMNA P02545 3/20 0.51
▸ POLB P06746 2/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ MAPK1 P28482 3/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ STAT3 P40763 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ APP P05067 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ NPC1 O15118 4/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ NR2F2 P24468 3/20 0.46
▸ GALR3 O60755 2/20 0.46
▸ GAA P10253 1/20 0.44
▸ USP2 O75604 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
SCHEMBL12811361 0.90 MAPT (0.41) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12811335 0.89 MAPT (0.52) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12788866 0.88 MAPT (0.48) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12788054 0.87 MAPT (0.48) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12788071 0.87 NPC1 (0.48) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL1437220 0.86 MAPT (0.47) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12811543 0.85 TP53 (0.41) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12788045 0.81 NPC1 (0.48) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12788920 0.81 MAPT (0.57) MAPTSMN1; SMN2HTTTSHRLMNA
SCHEMBL12788042 0.81 MAPT (0.47) MAPTSMN1; SMN2HTTTSHRLMNA

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-2011025505-A1 PTERIDINES AND THEIR USE AS AGROCHEMICALS DOW AGROSCIENCES LLC (US) 2011-03-03 — — WO disclosed
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