SCHEMBL8836296

SCHEMBL8836296

C=CC(=O)c1ccc(/C=C/c2ccc(C(=O)C=C)cc2F)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
EGFR P00533 1/20 0.49
TP53 P04637 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAPT P10636 1/20 0.49
PKM P14618 1/20 0.49
HPGD P15428 1/20 0.49
ALOX15 P16050 1/20 0.49
ALOX12 P18054 1/20 0.49
JAK1 P23458 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH5A1 P51649 1/20 0.47
ABAT P80404 1/20 0.47
CYP1A1 P04798 1/20 0.44

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
SCHEMBL8835817 0.92 NFE2L2 (0.53) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL2126134 0.82 CES2 (0.59) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL8835736 0.78 KDM4E (0.49) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL8836257 0.78 MEN1 (0.49) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL13977393 0.78 HDAC1 (0.56) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL8871990 0.76 ALDH5A1 (0.53) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL8836060 0.75 THRB (0.49) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL5262647 0.74 CES2 (0.56) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL20007006 0.74 HTT (0.65) KDM4EMEN1ALDH1A1EGFRTP53
SCHEMBL4256312 0.72 ALDH5A1 (0.80) KDM4EMEN1ALDH1A1EGFRTP53

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
US-5674576-A A LIGHT MODULATING LAYER COMPOSED OF LIQUID CRYSTAL AND HIGH POLYMER RESIN IS SANDWHICHED BETWEEN TWO SUBSTRATES HAVING ELECTRODE LAYERS, MONOMERS ARE OF(METH)ACRYLOYL COMPOUNDS WITH STIBENE OR (METH)ACRYLOYL WITH DIOXANE OR DIOXOLANES NEC CORPORATION (JP) 1997-10-07 US disclosed