SCHEMBL6615880

SCHEMBL6615880

c1ccc(OCc2cnc3cc4[nH]ncc4cc3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR1 Q9Y271 2/20 0.46
▸ CYSLTR2 Q9NS75 1/20 0.46
▸ KCNH2 Q12809 1/20 0.44
▸ NOS1 P29475 1/20 0.41
▸ CDC7 O00311 2/20 0.41
▸ FGFR1 P11362 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ FGFR2 P21802 1/20 0.40
▸ FGFR3 P22607 1/20 0.40
▸ DYRK3 O43781 1/20 0.40
▸ CLK1 P49759 1/20 0.40
▸ CLK2 P49760 1/20 0.40
▸ CLK3 P49761 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ DYRK1A Q13627 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
SCHEMBL6616216 1.00 CYSLTR1 (0.46) CYSLTR1CYSLTR2KCNH2NOS1CDC7
SCHEMBL6616873 0.84 MKNK1 (0.43) CDC7FGFR1TSHRDYRK3CLK1
SCHEMBL6618548 0.84 MKNK1 (0.43) CDC7FGFR1TSHRDYRK3CLK1
SCHEMBL6618464 0.82 ROCK2 (0.49) CDC7FGFR1DYRK3CLK1CLK2
SCHEMBL6618856 0.82 ROCK2 (0.49) CDC7FGFR1DYRK3CLK1CLK2
SCHEMBL6617033 0.81 ROCK2 (0.49) KCNH2CDC7FGFR1FGFR3DYRK3
SCHEMBL6617440 0.81 ROCK2 (0.49) KCNH2CDC7FGFR1FGFR3DYRK3
SCHEMBL8112159 0.80 HTT (0.56) FGFR1RAB9ANPC1FGFR2FGFR3
SCHEMBL6619697 0.80 HTT (0.56) FGFR1RAB9ANPC1FGFR2FGFR3
SCHEMBL6619746 0.80 HTT (0.56) FGFR1RAB9ANPC1FGFR2FGFR3

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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