SCHEMBL211113

SCHEMBL211113

C=CCC=C(CC=C)C(=O)OCC=C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.39
ALDH1A1 P00352 3/20 0.34
TSHR P16473 2/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 4/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PTP4A3 O75365 1/20 0.31
PTP4A1 Q93096 1/20 0.31
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SNCA P37840 1/20 0.31
APP P05067 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GLA P06280 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
Mellitic Acid SCHEMBL27825899 0.90 CYP3A4 (0.37) CYP3A4ALDH1A1TSHRHSD17B10MAPT
SCHEMBL252166 0.82
SCHEMBL252167 0.82
SCHEMBL15303566 0.80 TSHR (0.41) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL10901744 0.80 TSHR (0.39) CYP3A4ALDH1A1TSHRHSD17B10MAPT
SCHEMBL27557763 0.78 ALDH1A1 (0.33) ALDH1A1PKM
SCHEMBL481459 0.78 MAPT (0.38) CYP3A4ALDH1A1TSHRHSD17B10MAPT
Ammonia Solution, Strong SCHEMBL11223968 0.78 CYP3A4 (0.36) CYP3A4ALDH1A1TSHRHSD17B10MAPT
SCHEMBL10765616 0.78 TSHR (0.46) CYP3A4ALDH1A1TSHRTDP1
SCHEMBL3902728 0.77 CYP3A4 (0.35) CYP3A4ALDH1A1TSHRHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116640241-A Triallyl acrylic fluorine-containing resin and preparation method thereof 广州富唐新材料科技有限公司 2023-08-25 CN claimed
CN-116120694-A Thermal expansion microsphere with core-shell structure and preparation method thereof 万华化学集团股份有限公司 2023-05-16 CN claimed
CN-116640241-A Triallyl acrylic fluorine-containing resin and preparation method thereof 广州富唐新材料科技有限公司 2023-08-25 CN disclosed
CN-116529274-A Polymer composition for nonaqueous secondary battery and nonaqueous secondary battery 旭化成株式会社 2023-08-01 CN disclosed
CN-116120694-A Thermal expansion microsphere with core-shell structure and preparation method thereof 万华化学集团股份有限公司 2023-05-16 CN disclosed
EP-3833522-A1 METHOD FOR PRODUCING A THERMODEFORMABLE POLYMER/FIBER COMPOSITE BASF SE (DE) 2021-06-16 EP disclosed
WO-2020030330-A1 METHOD FOR PRODUCING A THERMODEFORMABLE POLYMER/FIBER COMPOSITE BASF SE (DE) 2020-02-13 WO disclosed
US-8089023-B2 Arc-extinguishing processed resin article and circuit breaker that uses same FUJI ELECTRIC FA COMPONENTS & SYSTEMS CO., LTD. 2012-01-03 US disclosed
US-20090200272-A1 ARC-EXTINGUISHING PROCESSED RESIN ARTICLE AND CIRCUIT BREAKER THAT USES SAME FUJI ELECTRIC FA COMPONENTS & SYSTEMS CO., LTD. (JP) 2009-08-13 US disclosed