SCHEMBL3229730

SCHEMBL3229730

C=CC(CC)=C(C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TSHR P16473 3/20 0.44
TDP1 Q9NUW8 2/20 0.35
FFAR3 O14843 1/20 0.35
LMNA P02545 1/20 0.35
FNTA P49354 2/20 0.33
FNTB P49356 2/20 0.33
THRB P10828 1/20 0.33
PGGT1B P53609 1/20 0.33
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPK1 P28482 1/20 0.32
HPGD P15428 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
SCHEMBL20237278 0.79 ALOX15 (0.45) ALDH1A1TSHRTDP1LMNAALOX15
SCHEMBL28420020 0.79 ALDH1A1 (0.42) ALDH1A1TSHRTDP1LMNAALOX15
SCHEMBL1823495 0.78 TDP1 (0.36) ALDH1A1TDP1FFAR3FNTAFNTB
SCHEMBL9174262 0.74 ALDH1A1 (0.42) ALDH1A1TSHRTDP1FFAR3LMNA
SCHEMBL11740585 0.74 TSHR (0.41) ALDH1A1TSHRTDP1FFAR3FNTA
SCHEMBL11809374 0.74 TSHR (0.41) ALDH1A1TSHRTDP1FFAR3FNTA
SCHEMBL27463219 0.74 ALDH1A1 (0.38) ALDH1A1TSHRHPGD
Bicarbonate SCHEMBL980934 0.73 ALDH1A1 (0.46) ALDH1A1TSHRTDP1FFAR3LMNA
SCHEMBL18901223 0.73 FFAR3 (0.32) ALDH1A1TDP1FFAR3FNTAFNTB
SCHEMBL10344061 0.73 ALDH1A1 (0.47) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108235706-B Method for preparing polymers based on acryloyl dimethyltaurate, neutral monomers and monomers having carboxylate groups 科莱恩国际有限公司 2020-11-20 CN disclosed
EP-2145758-B2 Packaging and packaging unit 3A TECH & MAN AG (CH) 2017-06-07 EP disclosed
EP-2145758-B1 Packaging film, packaging, packaging material packaging unit and application of a packaging film 3A TECHNOLOGY & MAN AG (CH) 2013-07-03 EP disclosed
WO-2010006710-A1 PACKAGING FILM, PACKAGE, PACKAGED GOODS PACKAGE UNIT, AND USE OF A PACKAGING FILM ALCAN TECHNOLOGY & MANAGMENT LTD. (CH) 2010-01-21 WO disclosed
EP-2145758-A1 Packaging film, packaging, packaging material packaging unit and application of a packaging film Alcan Technology & Management AG (CH) 2010-01-20 EP disclosed