SCHEMBL21761444

SCHEMBL21761444

CC1C/C=C/CC/C=C/CCCCCCCCCCCCCCC(=O)O1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 2/20 0.44
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.38
HSP90AB1 P08238 2/20 0.35
KIT P10721 4/20 0.34
PDGFRA P16234 4/20 0.34
FLT4 P35916 4/20 0.34
KDR P35968 4/20 0.34
FLT3 P36888 4/20 0.34
PDGFRB P09619 3/20 0.34
MAP2K1 Q02750 3/20 0.34
FLT1 P17948 3/20 0.34
MAP2K2 P36507 1/20 0.34
ALK Q9UM73 1/20 0.34
GEMIN4 P57678 1/20 0.34
HSF1 Q00613 1/20 0.34
NPC1 O15118 1/20 0.34
MITF O75030 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL19312328 1.00 MKNK2 (0.44) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL21761590 1.00 MKNK2 (0.44) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL19312322 1.00 MKNK2 (0.44) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL21761540 1.00 MKNK2 (0.44) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL17724028 1.00 MKNK2 (0.44) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL22734491 0.98 MKNK2 (0.45) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL7468957 0.98 MKNK2 (0.45) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL8467675 0.98 MKNK2 (0.45) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL7453339 0.98 MKNK2 (0.45) MKNK2CA1CA9SMN1; SMN2HSP90AB1
SCHEMBL24667613 0.92 MKNK2 (0.43) MKNK2CA1CA9SMN1; SMN2HSP90AB1

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-3214088-B1 METHOD FOR PRODUCING EUSHEARILIDES UNIV TOKYO SCIENCE FOUND (JP) 2020-02-26 EP disclosed