SCHEMBL27801239

SCHEMBL27801239

C=C(C(=O)OC)C1CCCCCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 1/20 0.37
TSHR P16473 2/20 0.35
EPHX1 P07099 2/20 0.35
RECQL P46063 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.34
NAAA Q02083 1/20 0.34

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
SCHEMBL2231567 1.00 CES2 (0.42) CES2CES1SMN1; SMN2HDAC8HDAC6
SCHEMBL28328782 1.00 CES2 (0.42) CES2CES1SMN1; SMN2HDAC8HDAC6
SCHEMBL27749723 1.00 CES2 (0.42) CES2CES1SMN1; SMN2HDAC8HDAC6
Hydroxyl Radical SCHEMBL28167821 0.98 CES2 (0.41) CES2CES1SMN1; SMN2HDAC8HDAC6
SCHEMBL27969028 0.98 CES2 (0.41) CES2CES1SMN1; SMN2HDAC8HDAC6
SCHEMBL613516 0.98 ALDH1A1 (0.42) CES2CES1SMN1; SMN2HDAC8HDAC6
Benzene SCHEMBL28199385 0.94 SMN1; SMN2 (0.41) CES2CES1SMN1; SMN2HDAC8HDAC6
Acetic Acid SCHEMBL28288702 0.94 ALDH1A1 (0.41) CES2CES1SMN1; SMN2HDAC8HDAC6
SCHEMBL6135392 0.93 ALDH1A1 (0.42) CES2CES1SMN1; SMN2HDAC8HDAC6
SCHEMBL28249215 0.92 SMN1; SMN2 (0.38) CES2CES1SMN1; SMN2HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107450268-A Color photoresist composition and method for detecting dielectric constant loss rate thereof 住华科技股份有限公司 2017-12-08 CN claimed
CN-106896643-A Photosensitive resin composition 住华科技股份有限公司 2017-06-27 CN claimed
CN-114829433-A Block copolymer, resin composition, stretchable conductor, electronic component, and adhesive film 东洋油墨SC控股株式会社 2022-07-29 CN disclosed
CN-104347157-B Transparent conductor and the optical display comprising the transparent conductor 三星SDI株式会社 2018-05-22 CN disclosed
CN-104347157-A Transparent conductor and optical display apparatus comprising the same SAMSUNG SDI CO LTD 2015-02-11 CN disclosed
CN-101957559-A Optical reversible nanoimprint photoresist as well as preparation method and application method thereof UNIV SHANGHAI JIAOTONG 2011-01-26 CN disclosed