SCHEMBL5262845

SCHEMBL5262845

O=C(O)c1cc2ccc(OCCN3CCCC3)cc2[nH]1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.69
PDGFRB P09619 3/20 0.64
PDGFRA P16234 2/20 0.64
DRD3 P35462 10/20 0.60
DRD2 P14416 8/20 0.60
LTA4H P09960 1/20 0.55
KDM4E B2RXH2 1/20 0.53
POLB P06746 1/20 0.53
HRH3 Q9Y5N1 1/20 0.52
ADRB1 P08588 1/20 0.51
HTR1A P08908 1/20 0.51
ADRA2C P18825 1/20 0.51
HTR2B P41595 1/20 0.51
TMEM97 Q5BJF2 1/20 0.51
SIGMAR1 Q99720 1/20 0.51

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
SCHEMBL6673646 0.91 DRD3 (0.64) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL31207849 0.90 PDGFRB (0.74) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL16599544 0.90 PDGFRB (0.74) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL3884146 0.87 FLT3 (0.71) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL27219357 0.82 HRH3 (0.67) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL7879688 0.81 FLT3 (0.60) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL3035497 0.80 KDM4E (0.52) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL7879689 0.80 FLT3 (0.59) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL13460613 0.80 PDGFRB (0.77) FLT3PDGFRBPDGFRADRD3DRD2
SCHEMBL30193808 0.80 MAOB (0.60) FLT3PDGFRBPDGFRADRD3DRD2

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-1841762-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE Aventis Pharma S.A. (FR) 2007-10-10 EP disclosed
WO-2006061493-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AVENTIS PHARMA S.A. (FR) 2006-06-15 WO disclosed