SCHEMBL9866308

SCHEMBL9866308

FC(F)(F)c1ccc(-c2nc3ncc(Cl)cc3o2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CETP P11597 2/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HRH3 Q9Y5N1 1/20 0.41
PTPN1 P18031 4/20 0.40
PTPN2 P17706 3/20 0.40
PTPN5 P54829 3/20 0.40
HSPD1 P10809 2/20 0.40
HSPE1 P61604 2/20 0.40
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
IKBKB O14920 1/20 0.40
TLR9 Q9NR96 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
UTRN P46939 1/20 0.39
NPC1 O15118 3/20 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
SCHEMBL9868637 0.85 SMN1; SMN2 (0.45) PTPN1PTPN2PTPN5HSPD1HSPE1
SCHEMBL9868913 0.78 NPC1 (0.46) CETPHDAC6NPC1RAB9AALDH1A1
SCHEMBL30788998 0.76 CETP (0.51) CETPHDAC3HDAC1HDAC2HDAC8
SCHEMBL9867163 0.75 NPC1 (0.66) PTPN1PTPN2PTPN5HSPD1HSPE1
SCHEMBL22259813 0.73 MAPT (0.42)
SCHEMBL25026542 0.72 HDAC3 (0.60) CETPHDAC3HDAC1HDAC2HDAC8
SCHEMBL31631303 0.72 NPC1 (0.64) IKBKBHSD17B10NPC1RAB9AALDH1A1
SCHEMBL24038157 0.72 NPC1 (0.57) HSD17B10NPC1RAB9AALDH1A1HPGD
SCHEMBL30648212 0.71 CHRNA7 (0.47) S1PR1S1PR3HTTHSD17B10NPC1
SCHEMBL27075892 0.71 CHRNA7 (0.47) S1PR1S1PR3HTTHSD17B10NPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5077408-A PROCESS FOR THE SYNTHESIS OF OXAZOLOPYRIDINE COMPOUNDS SCIENCE ET ORGANISATION (FR) 1991-12-31 US disclosed