SCHEMBL2597101

SCHEMBL2597101

O=C(C1=CCC1)C1=CCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC5 Q9UQL6 1/20 0.37
TSHR P16473 2/20 0.32
SLC6A1 P30531 1/20 0.32
SLC6A13 Q9NSD5 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRR1 P24046 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32

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
SCHEMBL6964110 0.80
SCHEMBL2774579 0.79 HDAC2 (0.60) HDAC4HDAC2HDAC8HDAC6HDAC3
SCHEMBL22290 0.78
SCHEMBL11674811 0.75 TSHR (0.50) HDAC4HDAC2HDAC8HDAC6HDAC3
SCHEMBL22639100 0.75
SCHEMBL1259101 0.75
SCHEMBL10895454 0.75
SCHEMBL11674817 0.75 TSHR (0.50) HDAC4HDAC2HDAC8HDAC6HDAC3
SCHEMBL9028437 0.75 HDAC2 (0.59) HDAC4HDAC2HDAC8HDAC6HDAC3
SCHEMBL11578150 0.73 PTPN1 (0.36) HDAC4HDAC2HDAC8HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115000626-A Photodegradable lithium battery diaphragm, battery and preparation method of battery 河北金力新能源科技股份有限公司 2022-09-02 CN claimed
CN-1085883-A Cated granulated fertilizer CHISSO CORP (JP) 1994-04-27 CN claimed
US-5258422-A Biodegradable blend of polymer, phosphorous compound, and oxidant TREDEGAR INDUSTRIES, INC. (US) 1993-11-02 US claimed
CN-115000626-A Photodegradable lithium battery diaphragm, battery and preparation method of battery 河北金力新能源科技股份有限公司 2022-09-02 CN disclosed
CN-104769026-B Surface modifying method and surface modified elastic body 住友橡胶工业株式会社 2018-09-18 CN disclosed
CN-107236258-A The conjugated polymer and device of doping 索尔维美国有限公司 2017-10-10 CN disclosed
CN-103959392-B Inject for hole and the improved doping method of transport layer 索尔维美国有限公司 2016-12-07 CN disclosed
EP-2571831-A2 GRANULAR FERTILIZER WITH CONTROLLED RELEASE OF NUTRIENTS Duslo, A.S. (SK) 2013-03-27 EP disclosed
WO-2011146027-A2 GRANULAR FERTILIZER WITH CONTROLLED RELEASE OF NUTRIENTS DUSLO, A.S. (SK) 2011-11-24 WO disclosed
WO-2011146026-A2 GRANULAR FERTILIZER WITH CONTROLLED RELEASE OF NUTRIENTS DUSLO, A.S. (SK) 2011-11-24 WO disclosed
CN-1085883-A Cated granulated fertilizer CHISSO CORP (JP) 1994-04-27 CN disclosed
US-5258422-A Biodegradable blend of polymer, phosphorous compound, and oxidant TREDEGAR INDUSTRIES, INC. (US) 1993-11-02 US disclosed