SCHEMBL4779689

SCHEMBL4779689

O=C(Nc1ccc(Cl)cc1)c1cc(-c2cncc3ccccc23)c[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 2/20 0.49
▸ 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
▸ KDR P35968 1/20 0.46
▸ TEK Q02763 1/20 0.46
▸ IKBKE Q14164 1/20 0.45
▸ TBK1 Q9UHD2 1/20 0.45
▸ ROCK2 O75116 1/20 0.44
▸ NAMPT P43490 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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 0.92 ABL1 (0.51) SERPINE1ABL1CSF1RIGF1RPDGFRB
SCHEMBL4777946 0.91 DEGS1 (0.47) SERPINE1ABL1CSF1RIGF1RPDGFRB
Hydrochloric Acid SCHEMBL4725333 0.91 ABL1 (0.50) SERPINE1ABL1CSF1RIGF1RPDGFRB
SCHEMBL4726551 0.90 KDR (0.51) SERPINE1ABL1CSF1RIGF1RPDGFRB
SCHEMBL4726122 0.90 KDR (0.46) SERPINE1ABL1CSF1RIGF1RPDGFRB
SCHEMBL4725045 0.90 KMT2A (0.48) ABL1CSF1RIGF1RPDGFRBKIT
SCHEMBL4726326 0.88 KDR (0.46) SERPINE1ABL1CSF1RIGF1RPDGFRB
SCHEMBL4726501 0.87 CYP3A4 (0.49) KDM4EMEN1GAAMAPTKMT2A
SCHEMBL4725931 0.87 CYP3A4 (0.49) ABL1CSF1RIGF1RPDGFRBKIT
SCHEMBL4727987 0.87 CFTR (0.53) ABL1CSF1RIGF1RPDGFRBKIT

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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