SCHEMBL4047016

SCHEMBL4047016

CC(CC(F)(F)F)c1nc2nccnc2[nH]1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33

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
SCHEMBL13905132 1.00 METAP2 (0.33) METAP2METAP1
SCHEMBL4048043 0.80 METAP2 (0.37) METAP2METAP1
SCHEMBL4046285 0.78 GPR84 (0.35) METAP2METAP1
SCHEMBL4043723 0.76 METAP2 (0.41) METAP2METAP1
SCHEMBL4047234 0.75 GPR84 (0.43) METAP2METAP1
SCHEMBL4048086 0.73 METAP2 (0.39) METAP2METAP1
SCHEMBL4054698 0.71 ADORA3 (0.40) METAP2METAP1
SCHEMBL4047107 0.69 PDE9A (0.35) METAP2METAP1
SCHEMBL13905292 0.69 PDE9A (0.35) METAP2METAP1
SCHEMBL4047123 0.66 METAP2 (0.36) METAP2METAP1

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-2009029592-A1 HETEROBICYCLIC-SUBSTITUTED QUINOLONES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS KALYPSYS, INC. (US) 2009-03-05 WO disclosed