SCHEMBL4348209

SCHEMBL4348209

Cc1cc(=O)n(-c2cccc(C(C)(C)C)c2)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
MAPT P10636 6/20 0.51
KDM4E B2RXH2 4/20 0.51
KMT2A Q03164 4/20 0.51
GAA P10253 2/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 1/20 0.51
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
BLM P54132 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RECQL P46063 1/20 0.49
ALKBH5 Q6P6C2 5/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
NOTUM Q6P988 1/20 0.43
MPL P40238 1/20 0.42
ALKBH3 Q96Q83 1/20 0.40
HDAC4 P56524 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
SCHEMBL4338425 0.86 ALKBH5 (0.64) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL4344344 0.82 ALDH1A1 (0.65) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL5675303 0.80 ALKBH5 (0.65) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL7456550 0.79 MAPT (0.44) ALDH1A1MAPTKMT2AGAAHTT
SCHEMBL4023307 0.79 MAPT (0.57) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL5425653 0.78 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL34121 0.78 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL9150171 0.78 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL7893151 0.78 MAPT (0.54) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL27912589 0.78 ALDH1A1 (0.54) ALDH1A1MAPTKDM4EKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101343251-B Thrombopoietin mimetics SMITHKLINE BEECHAM CORP 2011-11-09 CN disclosed
CN-101343250-B Thrombopoietin mimetics SMITHKLINE BEECHAM CORP 2011-09-21 CN disclosed
EP-1889838-B1 Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-10-14 EP disclosed
CN-101343251-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-01-14 CN disclosed
CN-101343250-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-01-14 CN disclosed
CN-101342169-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-01-14 CN disclosed
CN-100423721-C Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2008-10-08 CN disclosed
EP-1889838-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2008-02-20 EP disclosed
EP-1864981-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2007-12-12 EP disclosed
US-20040019190-A1 Thrombopoietin mimetics NOVARTIS AG (CH) 2004-01-29 US disclosed
CN-1444477-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2003-09-24 CN disclosed