SCHEMBL4597289

SCHEMBL4597289

Cc1ccc(NS(=O)(=O)Cc2ccccc2)cc1Nc1ncc(-c2ccncc2)o1.Cc1ccc(Nc2nc3ccccc3o2)cc1Nc1ncc(-c2ccc(C#N)cc2)o1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 5/20 0.40
FLT4 P35916 5/20 0.40
KDR P35968 5/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN5 P54829 1/20 0.40
KIT P10721 5/20 0.39
IMPDH2 P12268 5/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL2341841 0.86 KDR (0.50) FLT1FLT4KDRIMPDH2MEN1
SCHEMBL544184 0.85 KIT (0.46) FLT1FLT4KDRPTPN2PTPN1
SCHEMBL544079 0.83 NPC1 (0.54) FLT1FLT4KDRKITIMPDH2
SCHEMBL14058644 0.79 KDR (0.61) FLT1FLT4KDRPTPN2PTPN1
SCHEMBL2350226 0.75 RAB9A (0.58) FLT1FLT4KDRMEN1NPC1
SCHEMBL2342462 0.75 NPC1 (0.52) FLT1FLT4KDRKITIMPDH2
SCHEMBL544406 0.74 IMPDH2 (0.62) FLT1FLT4KDRKITIMPDH2
SCHEMBL2348479 0.74 FLT1 (0.46) FLT1FLT4KDRKITIMPDH2
SCHEMBL10033766 0.73 NPC1 (0.50) FLT1FLT4KDRIMPDH2MEN1
SCHEMBL2346767 0.72 IMPDH2 (0.44) FLT1FLT4KDRKITIMPDH2

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
EP-1874305-A2 SUBSTITUTED OXAZOLE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS AB Science (FR) 2008-01-09 EP claimed
WO-2006106437-A2 SUBSTITUTED OXAZOLE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS AB SCIENCE (FR) 2006-10-12 WO claimed