SCHEMBL6618578

SCHEMBL6618578

c1ccc(COc2cnc3cc4[nH]ncc4cc3n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 3/20 0.43
▸ PTGER1 P34995 2/20 0.41
▸ GABRP O00591 1/20 0.41
▸ GABRD O14764 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ GABRB2 P47870 1/20 0.41
▸ GABRA4 P48169 1/20 0.41
▸ GABRE P78334 1/20 0.41
▸ GABRA6 Q16445 1/20 0.41
▸ GABRG1 Q8N1C3 1/20 0.41
▸ GABRG3 Q99928 1/20 0.41
▸ GABRQ Q9UN88 1/20 0.41
▸ FGFR1 P11362 2/20 0.39
▸ GSK3B P49841 2/20 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
SCHEMBL6618275 1.00 CDC7 (0.43) CDC7PTGER1GABRPGABRDGABRA1
SCHEMBL6616873 0.83 MKNK1 (0.43) CDC7PTGER1FGFR1GSK3BCDK5
SCHEMBL6618548 0.83 MKNK1 (0.43) CDC7PTGER1FGFR1GSK3BCDK5
SCHEMBL8112159 0.81 HTT (0.56) FGFR1GSK3BCDK5DYRK1ADYRK3
SCHEMBL6619746 0.81 HTT (0.56) FGFR1GSK3BCDK5DYRK1ADYRK3
SCHEMBL6619697 0.81 HTT (0.56) FGFR1GSK3BCDK5DYRK1ADYRK3
SCHEMBL20571386 0.80 CCNB2 (0.43) CDC7GABRPGABRDGABRA1GABRB1
SCHEMBL6618464 0.78 ROCK2 (0.49) CDC7FGFR1GSK3BCDK5DYRK1A
SCHEMBL6618856 0.78 ROCK2 (0.49) CDC7FGFR1GSK3BCDK5DYRK1A
SCHEMBL6617440 0.77 ROCK2 (0.49) CDC7FGFR1GSK3BCDK5DYRK1A

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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