SCHEMBL6623309

SCHEMBL6623309

c1ccc2cc(-c3cnc4cc5cn[nH]c5cc4n3)ccc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.53
▸ GSK3B P49841 6/20 0.47
▸ CLK2 P49760 4/20 0.47
▸ CDK5 Q00535 4/20 0.47
▸ DYRK1A Q13627 4/20 0.47
▸ CLK4 Q9HAZ1 4/20 0.47
▸ FGFR1 P11362 4/20 0.47
▸ DYRK3 O43781 3/20 0.47
▸ CLK1 P49759 1/20 0.47
▸ CLK3 P49761 1/20 0.47
▸ CDK5R1 Q15078 1/20 0.47
▸ DYRK2 Q92630 1/20 0.47
▸ DYRK1B Q9Y463 1/20 0.47
▸ HPGD P15428 1/20 0.46
▸ ROCK2 O75116 5/20 0.43
▸ PIM1 P11309 5/20 0.43
▸ AURKB Q96GD4 4/20 0.43
▸ KDR P35968 3/20 0.43
▸ JAK2 O60674 2/20 0.43
▸ PAK4 O96013 1/20 0.43

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
SCHEMBL6620107 1.00 MAPK1 (0.53) MAPK1GSK3BCLK2CDK5DYRK1A
SCHEMBL6616738 0.86 SMN1; SMN2 (0.58) MAPK1GSK3BCLK2CDK5DYRK1A
SCHEMBL6616566 0.81 NPC1 (0.57) MAPK1GSK3BCLK2CDK5DYRK1A
SCHEMBL6617887 0.81 NPC1 (0.57) MAPK1GSK3BCLK2CDK5DYRK1A
SCHEMBL6618612 0.81 MAPK1 (0.49) MAPK1GSK3BCLK2CDK5DYRK1A
SCHEMBL6621230 0.81 MAPK1 (0.49) MAPK1GSK3BCLK2CDK5DYRK1A
SCHEMBL6619870 0.80 BCHE (0.54) MAPK1GSK3BFGFR1HPGDROCK2
SCHEMBL6617606 0.80 MAPK1 (0.51) MAPK1HPGDNPC1PDGFRBRAB9A
SCHEMBL8112788 0.80 CDC7 (0.50) MAPK1GSK3BDYRK1AFGFR1HPGD
SCHEMBL6616183 0.80 EGFR (0.47) MAPK1GSK3BCLK2CDK5DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0779889-B1 PYRAZOLO 3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE AVENTIS PHARMA INC (US) 2004-06-23 — — EP disclosed
EP-0779889-A4 PYRAZOLO 3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE RHONE POULENC RORER PHARMA (US) 2000-02-23 — — EP disclosed
EP-0779889-A1 PYRAZOLO 3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1997-06-25 — — EP disclosed
WO-1996007658-A1 PYRAZOLO[3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-03-14 — — WO disclosed
US-5476851-A Administering as therapeutic agents for various disease states which are characterized by uncontrolled cellular proliferation RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1995-12-19 — — US disclosed
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