SCHEMBL14070489

SCHEMBL14070489

FC(F)(F)c1ccnc(/C=N/Nc2ccc(CNc3ncccn3)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SYK P43405 7/20 0.38
SLC2A1 P11166 1/20 0.38
PKM P14618 1/20 0.36

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
SCHEMBL14029915 0.83 SLC2A1 (0.41) HDAC1HDAC8HDAC6SLC2A1
SCHEMBL14005000 0.81 NPC1 (0.45) HDAC1HDAC8HDAC6SYKPKM
SCHEMBL13879819 0.74 PKM (0.52) HDAC1HDAC8HDAC6SYKPKM
SCHEMBL13879795 0.69 KDM4E (0.50) HDAC1HDAC8HDAC6PKM
Msx-122 SCHEMBL10054965 0.66 CXCR4 (0.61) HDAC1HDAC8HDAC6
SCHEMBL15719106 0.66 RAB9A (0.54) PKM
SCHEMBL15719105 0.66 RAB9A (0.54) PKM
SCHEMBL13891925 0.65 SYK (0.47) HDAC1HDAC6SYKPKM
SCHEMBL14005153 0.65 PKM (0.61) SYKPKM
SCHEMBL14025742 0.65 NAMPT (0.52) SYKPKM

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
WO-2008112156-A1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS (US) 2008-09-18 WO disclosed