SCHEMBL2760552

SCHEMBL2760552

C[SiH2]OC(O[SiH2]C)C(C)(C)CCCn1cc(C#N)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.56
▸ HTT P42858 4/20 0.56
▸ L3MBTL1 Q9Y468 4/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ TDP1 Q9NUW8 3/20 0.55
▸ LMNA P02545 2/20 0.55
▸ TSHR P16473 2/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ ALDH1A1 P00352 5/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ P2RX7 Q99572 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ IMPDH2 P12268 1/20 0.43
▸ STAT3 P40763 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL3101413 0.93 MAPT (0.52) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL3111324 0.84 HTT (0.43) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL3229455 0.78 PDE4B (0.41) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL27957397 0.74 MAPT (0.66) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL8240740 0.73 MAPT (0.74) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL2263584 0.73 SLC6A2 (0.33) MAPTSMN1; SMN2P2RX7
SCHEMBL1077430 0.73 MAPT (0.64) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL1777652 0.71 MAPT (0.62) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL17179186 0.68 MAPT (0.74) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL1779408 0.68 MAPT (0.58) MAPTHTTL3MBTL1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2233486-A1 Azaindoles Aventis Pharma Limited (GB) 2010-09-29 — — EP disclosed
EP-1263759-B1 AZAINDOLES AVENTIS PHARMA LTD (GB) 2010-09-08 — — EP disclosed
EP-1990343-A2 Azaindoles Aventis Pharma Limited (GB) 2008-11-12 — — EP disclosed
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