SCHEMBL4726326

SCHEMBL4726326

O=C(Nc1ccc(=O)[nH]c1)c1cc(-c2cncc3ccccc23)c[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 3/20 0.46
▸ ABL1 P00519 1/20 0.46
▸ CSF1R P07333 1/20 0.46
▸ IGF1R P08069 1/20 0.46
▸ PDGFRB P09619 1/20 0.46
▸ KIT P10721 1/20 0.46
▸ FGFR1 P11362 1/20 0.46
▸ FLT1 P17948 1/20 0.46
▸ FLT4 P35916 1/20 0.46
▸ TEK Q02763 1/20 0.46
▸ MMP9 P14780 2/20 0.43
▸ MMP1 P03956 1/20 0.43
▸ IKBKE Q14164 1/20 0.43
▸ TBK1 Q9UHD2 1/20 0.43
▸ ROCK2 O75116 1/20 0.42
▸ NAMPT P43490 1/20 0.42
▸ CFTR P13569 2/20 0.42
▸ ITK Q08881 1/20 0.41
▸ SERPINE1 P05121 1/20 0.41
▸ SCN8A Q9UQD0 1/20 0.41

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
SCHEMBL4727611 0.89 ABL1 (0.51) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4777946 0.89 DEGS1 (0.47) KDRABL1CSF1RIGF1RPDGFRB
Hydrochloric Acid SCHEMBL4725333 0.89 ABL1 (0.50) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4725045 0.88 KMT2A (0.48) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4726122 0.88 KDR (0.46) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4779689 0.88 SERPINE1 (0.49) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4730202 0.86 NPC1 (0.51) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4727987 0.85 CFTR (0.53) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4725931 0.85 CYP3A4 (0.49) KDRABL1CSF1RIGF1RPDGFRB
SCHEMBL4726501 0.85 CYP3A4 (0.49) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008021725-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-21 — — WO claimed
WO-2008021725-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-21 — — WO disclosed
WO-2008021725-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-21 — — WO disclosed
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