SCHEMBL22561053

SCHEMBL22561053

C=CC(=O)c1ccc2cc(-c3ccc(OC(=O)C(=C)COC)cc3)ccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ALDH1A1 P00352 1/20 0.45
EGFR P00533 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
ALOX12 P18054 1/20 0.45
JAK1 P23458 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PLAU P00749 4/20 0.35
PLG P00747 1/20 0.34
PLAT P00750 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
SCHEMBL22459768 0.85 MAPT (0.43) MEN1KMT2AKDM4EHSD17B10CYP3A4
SCHEMBL22561084 0.84 KDM4E (0.37) MEN1KMT2AKDM4EHSD17B10ALDH1A1
SCHEMBL22459359 0.84 THRB (0.48) KMT2AKDM4EHSD17B10ALDH1A1MAPT
SCHEMBL22459372 0.81 PLAU (0.35) MEN1KMT2AKDM4EHSD17B10CYP3A4
SCHEMBL22459868 0.81 HSD17B10 (0.40) MEN1KMT2AHSD17B10ALDH1A1MAPT
SCHEMBL22459345 0.81 HSD17B10 (0.40) MEN1KMT2AHSD17B10ALDH1A1MAPT
SCHEMBL22459397 0.81 HSD17B10 (0.40) MEN1KMT2AHSD17B10ALDH1A1MAPT
SCHEMBL22083551 0.79 THRB (0.39) MEN1KMT2AKDM4EALDH1A1EGFR
SCHEMBL22459259 0.77 KMT2A (0.37) MEN1KMT2AKDM4EHSD17B10ALDH1A1
SCHEMBL22459616 0.76 ELANE (0.49) MEN1KMT2AHSD17B10ALDH1A1MAPT

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-3725764-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2020-10-21 EP disclosed