SCHEMBL14606038

SCHEMBL14606038

C/C=C(C)\C=C(/C)c1cnc2ccc(NCc3ccc(OC)cc3)nn12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 15/20 0.58
▸ PIM1 P11309 3/20 0.55
▸ MKNK1 Q9BUB5 1/20 0.44
▸ JAK2 O60674 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ NTRK1 P04629 1/20 0.41
▸ INSR P06213 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ LYN P07948 1/20 0.41
▸ RET P07949 1/20 0.41
▸ IGF1R P08069 1/20 0.41
▸ MET P08581 1/20 0.41
▸ ROS1 P08922 1/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ FGR P09769 1/20 0.41
▸ KIT P10721 1/20 0.41
▸ SRC P12931 1/20 0.41
▸ BRAF P15056 1/20 0.41
▸ FLT1 P17948 1/20 0.41

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
SCHEMBL1203600 0.83 FYN (0.59) FYNPIM1MKNK1NTRK1
SCHEMBL2951694 0.81 FYN (0.78) FYNPIM1MKNK1JAK2ABL1
SCHEMBL1203409 0.79 FYN (0.56) FYNPIM1NTRK1
SCHEMBL15688830 0.79 FYN (0.62) FYNPIM1MKNK1
SCHEMBL1203735 0.78 FYN (0.52) FYNPIM1NTRK1
SCHEMBL2940129 0.78 FYN (0.73) FYNPIM1MKNK1JAK2ABL1
SCHEMBL1054209 0.78 FYN (0.76) FYNPIM1MKNK1JAK2ABL1
SCHEMBL2940455 0.77 FYN (0.78) FYNPIM1MKNK1JAK2ABL1
SCHEMBL2943534 0.77 FYN (0.76) FYNPIM1MKNK1JAK2ABL1
SCHEMBL2948785 0.77 FYN (0.76) FYNPIM1MKNK1JAK2ABL1

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-2007025540-A2 SUBSTITUTED IMIDAZO[1,2B]PYRIDAZINES AS KINASE INHIBITORS, THE PRODUCTION THEREOF, AND USE OF THE SAME AS MEDICAMENTS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-08 — — WO disclosed
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