SCHEMBL4725101

SCHEMBL4725101

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ CSF1R P07333 2/20 0.49
▸ ABL1 P00519 1/20 0.49
▸ IGF1R P08069 1/20 0.49
▸ PDGFRB P09619 1/20 0.49
▸ KIT P10721 1/20 0.49
▸ FGFR1 P11362 1/20 0.49
▸ FLT1 P17948 1/20 0.49
▸ FLT4 P35916 1/20 0.49
▸ KDR P35968 1/20 0.49
▸ TEK Q02763 1/20 0.49
▸ HIF1A Q16665 1/20 0.46
▸ MMP9 P14780 2/20 0.44
▸ MMP1 P03956 1/20 0.44
▸ ATR Q13535 1/20 0.41
▸ CFTR P13569 2/20 0.40
▸ BRAF P15056 1/20 0.40
▸ SERPINE1 P05121 1/20 0.40
▸ CYP3A4 P08684 2/20 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
SCHEMBL4725931 0.91 CYP3A4 (0.49) MEN1KMT2ACSF1RABL1IGF1R
SCHEMBL4730317 0.88 KDR (0.51) MEN1KMT2ACSF1RABL1IGF1R
SCHEMBL4727611 0.87 ABL1 (0.51) CSF1RABL1IGF1RPDGFRBKIT
Hydrochloric Acid SCHEMBL4725333 0.86 ABL1 (0.50) CSF1RABL1IGF1RPDGFRBKIT
SCHEMBL4726551 0.86 KDR (0.51) MEN1KMT2ACSF1RABL1IGF1R
SCHEMBL4725360 0.85 POLB (0.50) MEN1KMT2ACSF1RABL1IGF1R
SCHEMBL4726488 0.84 ABL1 (0.49) MEN1KMT2ACSF1RABL1IGF1R
SCHEMBL4725045 0.84 KMT2A (0.48) MEN1KMT2ACSF1RABL1IGF1R
SCHEMBL4730202 0.84 NPC1 (0.51) MEN1KMT2ACSF1RABL1IGF1R
SCHEMBL4725913 0.83 RXFP1 (0.53) MEN1KMT2ACSF1RABL1IGF1R

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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