SCHEMBL16852610

SCHEMBL16852610

C=CC(=O)OCOc1ccc(C(=O)Oc2ccc(Cc3ccc(OC(=O)c4ccc(OCOC(=O)C=C)cc4)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.44
PRSS1 P07477 3/20 0.39
KMT2A Q03164 2/20 0.39
F2 P00734 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
ELANE P08246 1/20 0.38
TMPRSS2 O15393 1/20 0.38
KLK1 P06870 1/20 0.38
TP53 P04637 1/20 0.38
HSD17B10 Q99714 1/20 0.37
ACR P10323 1/20 0.37
PARP10 Q53GL7 1/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP3 P42574 1/20 0.36
SENP7 Q9BQF6 1/20 0.36

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
SCHEMBL742922 0.93 THRB (0.46) THRBPRSS1KMT2AF2PRSS2
SCHEMBL16449835 0.93 THRB (0.46) THRBPRSS1KMT2AF2PRSS2
SCHEMBL11917937 0.93 THRB (0.46) THRBPRSS1KMT2AF2PRSS2
SCHEMBL16449870 0.93 THRB (0.46) THRBPRSS1KMT2AF2PRSS2
SCHEMBL16449833 0.93 THRB (0.46) THRBPRSS1KMT2AF2PRSS2
SCHEMBL16449879 0.93 THRB (0.46) THRBPRSS1KMT2AF2PRSS2
SCHEMBL19930189 0.92 THRB (0.51) THRBPRSS1KMT2AF2PRSS2
SCHEMBL12733830 0.92 THRB (0.51) THRBPRSS1KMT2AF2PRSS2
SCHEMBL12723906 0.92 THRB (0.45) THRBPRSS1KMT2AF2PRSS2
SCHEMBL17734099 0.92 THRB (0.45) THRBPRSS1KMT2AF2PRSS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150361345-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-12-17 US disclosed
US-20150177567-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING THEREOF CHI MEI CORPORATION (TW) 2015-06-25 US disclosed