SCHEMBL19337995

SCHEMBL19337995

CCOC(=O)c1ccc(-c2ccc3nnc(CC4/C=C(\C)CCO/C=C/C4)n3n2)s1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
HSD17B10 Q99714 1/20 0.32
MET P08581 3/20 0.31
ERN1 O75460 1/20 0.30

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
SCHEMBL2491763 0.72 MET (0.47) MET
SCHEMBL2496459 0.71 MET (0.59) METERN1
SCHEMBL2494801 0.66 CLK1 (0.42) MAPTMETERN1
SCHEMBL2494891 0.65 MET (0.65) MET
SCHEMBL2498747 0.61 MET (0.39) MAPTHSD17B10METERN1
SCHEMBL2492178 0.59 HDAC3 (0.48) MAPTHSD17B10ERN1
SCHEMBL17201672 0.58 ERN1 (0.48) MAPTHSD17B10ERN1
SCHEMBL2362973 0.57 HDAC3 (0.51) HSD17B10ERN1
SCHEMBL17201566 0.56 HDAC3 (0.47) MAPTHSD17B10ERN1
SCHEMBL7018973 0.56 HDAC3 (0.73) MAPTHSD17B10ERN1

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
EP-1966214-B9 TRIAZOLOPYRIDAZINES AS TYROSINE KINASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2017-09-13 EP disclosed