SCHEMBL13733086

SCHEMBL13733086

Cc1cccc2nn(C)c(N)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.41
▸ ACHE P22303 5/20 0.39
▸ BCHE P06276 3/20 0.38
▸ GRIN1 Q05586 3/20 0.38
▸ GRIN2A Q12879 3/20 0.38
▸ POLB P06746 1/20 0.37
▸ TLR8 Q9NR97 1/20 0.36
▸ PARP1 P09874 2/20 0.36
▸ ELANE P08246 2/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ CD44 P16070 1/20 0.34
▸ SLC9A1 P19634 1/20 0.34
▸ KEAP1 Q14145 1/20 0.34
▸ HRH4 Q9H3N8 1/20 0.34
▸ EPHB4 P54760 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ RAB9A P51151 1/20 0.33

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
SCHEMBL31439989 0.79 BACE1 (0.38) MAPTPOLBSLC9A1KEAP1HRH4
SCHEMBL2914480 0.71 MAPT (0.46) MAPTACHEPOLBKMT2AHTT
SCHEMBL14416828 0.69 HRH4 (0.42) MAPTPOLBTLR8PARP1ELANE
SCHEMBL590272 0.69 KDR (0.43) MAPTTLR8KMT2ACD44MEN1
SCHEMBL9138367 0.65 GRM4 (0.46) MAPTTLR8HTTSLC9A1KEAP1
SCHEMBL16506376 0.65 PDE10A (0.38) SLC9A1KEAP1NPC1RAB9A
SCHEMBL13106159 0.65 PARP1 (0.41) PARP1ELANESLC9A1KEAP1
SCHEMBL11627568 0.65 ELANE (0.45) ACHEPARP1ELANE
SCHEMBL29059152 0.65 KAT2B (0.47) —
SCHEMBL12536276 0.64 MAPK13 (0.42) MAPTKMT2AHTTSLC9A1KEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103910716-A 2,4-disubstituted-cycloalkyl[d]pyrimidine compound and its use UNIV EAST CHINA SCIENCE & TECH 2014-07-09 — — CN disclosed
CN-103739550-A 2, 3-dimethyl-6-urea-2H-indazole compound and preparation method and application thereof UNIV CHINA PHARMA 2014-04-23 — — CN disclosed
EP-2699579-A1 PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 — — EP disclosed
WO-2012143144-A1 PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 — — WO disclosed
CN-101370505-B Treatment of ocular neovascular disorders such as macular degeneration, angioid streaks, uveitis and macular edema SMITHKLINE BEECHAM CORP 2012-03-21 — — CN disclosed
CN-101370505-A Treatment of ocular neovascular disorders such as macular degeneration, angioid streaks, uveitis and macular edema SMITHKLINE BEECHAM CORP (US) 2009-02-18 — — CN disclosed
CN-1307173-C Pyrimidinamines as angiogenesis modulators GLAXO GROUP LTD (GB) 2007-03-28 — — CN disclosed
CN-1688553-A Chemical process SMITHKLINE BEECHAM CORP (US) 2005-10-26 — — CN disclosed
CN-1549813-A Pyrimidinamines as angiogenesis modulators — 2004-11-24 — — CN disclosed
Send feedback