SCHEMBL469993

SCHEMBL469993

CC(C)(O)CNc1cc(-c2ccc(F)cc2)nn2c(-c3ccc(C=O)cc3)cnc12

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FYN P06241 9/20 0.49
TTK P33981 6/20 0.46
MKNK1 Q9BUB5 3/20 0.36
PIM1 P11309 2/20 0.36
ASIC1 P78348 1/20 0.36
MET P08581 1/20 0.35

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
SCHEMBL458258 0.91 TTK (0.51) FYNTTKPIM1
SCHEMBL10279704 0.90 TTK (0.46) FYNTTKMKNK1
SCHEMBL456541 0.83 TTK (0.46) FYNTTKPIM1
SCHEMBL469994 0.81 FYN (0.47) FYNTTKMKNK1PIM1
SCHEMBL459406 0.81 TTK (0.70) FYNTTK
SCHEMBL470024 0.81 TTK (0.43) FYNTTKPIM1
SCHEMBL456226 0.81 TTK (0.41) FYNTTKPIM1
SCHEMBL458134 0.80 F2 (0.38) ASIC1
SCHEMBL469992 0.79 TTK (0.57) FYNTTK
SCHEMBL456204 0.79 TTK (0.45) FYNTTK

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 3 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
WO-2012032031-A1 SUBSTITUTED IMIDAZOPYRIDAZINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-15 WO disclosed