SCHEMBL6622035

SCHEMBL6622035

COc1cc(OC)cc(-c2cnc3cc4[nH]ncc4cc3n2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ TLR8 Q9NR97 1/20 0.42
▸ AXL P30530 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CYP1A1 P04798 2/20 0.41
▸ CYP1B1 Q16678 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ FGFR3 P22607 8/20 0.40
▸ FGFR1 P11362 7/20 0.40
▸ FGFR2 P21802 7/20 0.40
▸ FGFR4 P22455 7/20 0.40
▸ KDR P35968 7/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2E1 P05181 1/20 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
SCHEMBL6618516 1.00 GAA (0.44) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL8143522 0.89 GAA (0.45) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL8112499 0.88 MAPK1 (0.51) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL6618338 0.88 MAPK1 (0.51) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL6617606 0.88 MAPK1 (0.51) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL6616674 0.87 FGFR1 (0.48) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL6620076 0.87 FGFR1 (0.48) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL6618374 0.81 MAP3K11 (0.55) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL6618763 0.81 MAP3K11 (0.55) GAAMAPTALDH1A1GLASMN1; SMN2
SCHEMBL6616714 0.79 MAPK1 (0.44) SMN1; SMN2MAPK1NPC1RAB9AFGFR3

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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