SCHEMBL4726488

SCHEMBL4726488

NC(=O)c1cccc(NC(=O)c2cc(-c3cncc4ccccc34)c[nH]c2=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 2/20 0.49
▸ CSF1R P07333 2/20 0.49
▸ FGFR1 P11362 2/20 0.49
▸ FLT1 P17948 2/20 0.49
▸ FLT4 P35916 2/20 0.49
▸ KDR P35968 2/20 0.49
▸ IGF1R P08069 1/20 0.49
▸ PDGFRB P09619 1/20 0.49
▸ KIT P10721 1/20 0.49
▸ TEK Q02763 1/20 0.49
▸ MMP9 P14780 2/20 0.49
▸ MMP1 P03956 1/20 0.49
▸ SIRT2 Q8IXJ6 4/20 0.45
▸ SIRT3 Q9NTG7 4/20 0.45
▸ SIRT1 Q96EB6 3/20 0.45
▸ SERPINE1 P05121 1/20 0.44
▸ CFTR P13569 2/20 0.43
▸ ATR Q13535 2/20 0.41
▸ TYK2 P29597 1/20 0.40
▸ IKBKE Q14164 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
SCHEMBL4727611 0.88 ABL1 (0.51) ABL1CSF1RFGFR1FLT1FLT4
Hydrochloric Acid SCHEMBL4725333 0.87 ABL1 (0.50) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4730317 0.87 KDR (0.51) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4726551 0.87 KDR (0.51) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4726825 0.85 CA1 (0.52) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4730202 0.84 NPC1 (0.51) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4725913 0.84 RXFP1 (0.53) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4725360 0.84 POLB (0.50) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4725101 0.84 MEN1 (0.55) ABL1CSF1RFGFR1FLT1FLT4
SCHEMBL4725980 0.84 ABL1 (0.49) ABL1CSF1RFGFR1FLT1FLT4

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 2 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
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