SCHEMBL2674149

SCHEMBL2674149

O=CCC(C(=O)O)=C(C1CCCC1)C1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
HSD11B1 P28845 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
EPHX1 P07099 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL28785459 0.79 EPHX1 (0.38) CES2CES1HSD11B1EPHX1
SCHEMBL998084 0.78 EPHX1 (0.41) CES2CES1HSD11B1HDAC8HDAC6
SCHEMBL8415539 0.78 EPHX1 (0.41) CES2CES1HSD11B1HDAC8HDAC6
SCHEMBL29958298 0.73 CES2 (0.42) CES2CES1HSD11B1HDAC8HDAC6
SCHEMBL4807289 0.71 CES2 (0.46) CES2CES1HSD11B1HDAC8HDAC6
SCHEMBL15673240 0.69 CES2 (0.48) CES2CES1HSD11B1HDAC8HDAC6
SCHEMBL15673128 0.67 CES2 (0.52) CES2CES1HSD11B1HDAC8HDAC6
SCHEMBL11846823 0.67 EPHX1 (0.42) CES2CES1EPHX1
SCHEMBL6521108 0.67 CES2 (0.40) CES2CES1HDAC8HDAC6EPHX1
SCHEMBL6521093 0.67 CES2 (0.40) CES2CES1HDAC8HDAC6EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101051186-B Negative photosensitive resin composition DONGJIN SEMICHEM CO LTD 2012-06-27 CN disclosed
US-8173729-B2 Photosensitive resin composition DONGJIN SEMICHEM CO., LTD. (KR) 2012-05-08 US disclosed
US-20100222473-A1 PHOTOSENSITIVE RESIN COMPOSITION DONGJIN SEMICHEM CO., LTD. (KR) 2010-09-02 US disclosed
CN-101051186-A Negative photosensitive resin composition DONGJIN SEMICHEM CO LTD (KR) 2007-10-10 CN disclosed