SCHEMBL458866

SCHEMBL458866

CC(C)(C)OC(=O)N(CCC(F)(F)F)c1cc(Br)nn2ccnc12

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.33
HCRTR2 O43614 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
SCHEMBL457810 0.86 HCRTR2 (0.34) HCRTR2
SCHEMBL16018372 0.82 L3MBTL1 (0.39) SSTR4HCRTR2
SCHEMBL17425405 0.81 JAK2 (0.32)
SCHEMBL17425406 0.81 IRAK4 (0.34) HCRTR2
SCHEMBL16018378 0.73 F2 (0.36) HCRTR2
SCHEMBL16018371 0.72 SSTR4 (0.31) SSTR4
SCHEMBL16018376 0.69 TTK (0.34)
SCHEMBL16018375 0.69 TTK (0.35) HCRTR2
SCHEMBL457318 0.69 LNPEP (0.34) HCRTR2
SCHEMBL16018387 0.68 L3MBTL1 (0.40) SSTR4

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
US-9255100-B2 Substituted imidazopyridazines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-02-09 US disclosed
EP-2614063-B1 SUBSTITUTED IMIDAZOPYRIDAZINES BAYER IP GMBH (DE) 2016-01-13 EP disclosed