SCHEMBL6063572

SCHEMBL6063572

C=C(C)C(=O)OC.C=C(C)C(=O)OCCO.C=C(Cc1c2ccccc2cc2ccccc12)C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.35
EPHX1 P07099 1/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HPGD P15428 2/20 0.32
THRB P10828 1/20 0.31
TSHR P16473 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
HTR2A P28223 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL559460 0.85 HTR2A (0.41) EDNRAEPHX1ALDH1A1KDM4ENPSR1
SCHEMBL5478822 0.84 KDM4E (0.35) EDNRAEPHX1ALDH1A1KDM4ENPSR1
SCHEMBL4872539 0.79 HCAR2 (0.31) KDM4ENPSR1
SCHEMBL5594535 0.78 RAD52 (0.45) EDNRAEPHX1ALDH1A1KDM4EPOLB
SCHEMBL6832199 0.75 KDM4E (0.46) EPHX1ALDH1A1KDM4ENPSR1TDP1
SCHEMBL29625710 0.75 EPHX1 (0.49) EDNRAEPHX1ALDH1A1KDM4ENPSR1
SCHEMBL216321 0.75 EPHX1 (0.49) EDNRAEPHX1ALDH1A1KDM4ENPSR1
SCHEMBL6425707 0.74 KDM4E (0.35) EDNRAEPHX1ALDH1A1KDM4ENPSR1
SCHEMBL8065282 0.74 THRB (0.46) EDNRAEPHX1ALDH1A1KDM4ENPSR1
SCHEMBL28989675 0.74 TSHR (0.45) EPHX1KDM4ENPSR1POLBAPEX1

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-20060153987-A1 Organic bottom anti-feflective composition and patterning method using the same DONGJIN SEMICHEM CO., LTD. (KR) 2006-07-13 US disclosed