SCHEMBL21470125

SCHEMBL21470125

C=CC(=O)Oc1ccc(OC(=O)c2ccc(OC(=O)c3ccc(-c4ccc(OC(=O)C=C)cc4)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.49
HSD17B10 Q99714 2/20 0.48
PARP10 Q53GL7 1/20 0.47
F2 P00734 3/20 0.46
PRSS1 P07477 3/20 0.46
PRSS2 P07478 3/20 0.46
PRSS3 P35030 3/20 0.46
KMT2A Q03164 6/20 0.44
MAPT P10636 5/20 0.44
GFER P55789 1/20 0.44
TDP1 Q9NUW8 3/20 0.43
MEN1 O00255 2/20 0.43
HGFAC Q04756 1/20 0.42
RAB9A P51151 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PKM P14618 2/20 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
SCHEMBL22566480 1.00 THRB (0.49) THRBHSD17B10PARP10F2PRSS1
SCHEMBL22566606 1.00 THRB (0.49) THRBHSD17B10PARP10F2PRSS1
SCHEMBL15695635 1.00 THRB (0.49) THRBHSD17B10PARP10F2PRSS1
SCHEMBL7455238 0.94 HSD17B10 (0.53) THRBHSD17B10PARP10F2PRSS1
SCHEMBL14130799 0.93 PARP10 (0.54) THRBPARP10PRSS1KMT2AMAPT
SCHEMBL10015751 0.93 SENP1 (0.50) THRBHSD17B10PARP10F2PRSS1
SCHEMBL21470016 0.92 KMT2A (0.56) THRBPRSS1KMT2AMAPTGFER
SCHEMBL13859677 0.92 KMT2A (0.56) THRBPRSS1KMT2AMAPTGFER
SCHEMBL20105062 0.92 KMT2A (0.56) THRBPRSS1KMT2AMAPTGFER
SCHEMBL21469945 0.91 KMT2A (0.50) THRBHSD17B10PARP10F2PRSS1

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-3339396-B1 LIQUID CRYSTAL DISPLAY DEVICE AND LIQUID CRYSTAL COMPOSITION INCLUDED THEREIN SAMSUNG DISPLAY CO LTD (KR) 2019-10-16 EP disclosed