SCHEMBL27770677

SCHEMBL27770677

C/C=C/C=C/C(=O)OCc1cccc(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.48
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP12 P39900 1/20 0.47
LMNA P02545 1/20 0.47
IDO1 P14902 2/20 0.45
MAOB P27338 4/20 0.45
MAOA P21397 2/20 0.44
ALOX5 P09917 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
AKR1B10 O60218 2/20 0.43
AKR1B1 P15121 2/20 0.43
CA12 O43570 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43

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
SCHEMBL28592782 0.90 HCAR2 (0.51) HCAR2MMP2MMP9MMP12LMNA
SCHEMBL8893773 0.83 MMP2 (0.52) HCAR2MMP2MMP9MMP12LMNA
SCHEMBL27636866 0.83 HCAR2 (0.65) HCAR2LMNAMAOBMAOAPOLB
SCHEMBL1560436 0.83 HCAR2 (0.65) HCAR2LMNAMAOBMAOAPOLB
SCHEMBL1592402 0.79 MMP2 (0.51) HCAR2MMP2MMP9MMP12LMNA
SCHEMBL11828605 0.77 ALOX5 (0.53) HCAR2LMNAALOX5POLBMAPT
SCHEMBL11828612 0.77 ALOX5 (0.53) HCAR2LMNAALOX5POLBMAPT
SCHEMBL3763603 0.76 IDO1 (0.58) MMP2MMP9MMP12IDO1MAOB
Toluene SCHEMBL28861236 0.76 MAPT (0.48) HCAR2LMNAMAPTCA12CA7
SCHEMBL6903259 0.75 ALDH1A1 (0.63) MMP2MMP9MMP12LMNAIDO1

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-101643634-B Polyethylene glue nucleation melting-boosting adhesive special for oil and gas pipelines SHANGHAI HILONG SHINE NEW MATERIAL CO LTD 2011-06-22 CN claimed
CN-102432763-A Preparation method of adhesive for corrosion prevention of steel pipeline SHANGHAI HAILONG SAINENG NEW MATERIALS CO LTD 2012-05-02 CN disclosed
CN-101643634-B Polyethylene glue nucleation melting-boosting adhesive special for oil and gas pipelines SHANGHAI HILONG SHINE NEW MATERIAL CO LTD 2011-06-22 CN disclosed
CN-101643634-A Polyethylene glue nucleation melting-boosting adhesive special for oil and gas pipelines SHANGHAI HILONG SHINE NEW MATE 2010-02-10 CN disclosed