SCHEMBL7800543

SCHEMBL7800543

C#CCc1ccc(COC(=O)C2C(/C=C/C(=O)OCC)C2(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
TDP1 Q9NUW8 4/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
ADRA2A P08913 1/20 0.39
CNR1 P21554 1/20 0.39
ATM Q13315 1/20 0.39
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ADORA3 P0DMS8 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
SCHEMBL7800544 1.00 LMNA (0.40) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL7798177 0.90 TDP1 (0.39) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL7796586 0.86 LMNA (0.44) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL7796589 0.86 LMNA (0.44) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL6899482 0.81 TDP1 (0.48) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL7798167 0.78 TDP1 (0.36) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL7798166 0.78 TDP1 (0.36) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL8150336 0.77 TDP1 (0.44) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL7799335 0.76 TDP1 (0.42) LMNATDP1L3MBTL1ADRA2ACNR1
SCHEMBL7799337 0.76 TDP1 (0.42) LMNATDP1L3MBTL1ADRA2ACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754674-B1 NOVEL CARBOXYLIC ESTER DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND INSECTICIDE OR INSECTIFUGE CONTAINING THE SAME DAINIPPON JOCHUGIKU KK (JP) 2001-12-19 EP disclosed
US-6107339-A Derivative of ester of carboxylic acid, and insecticide and insect proofing agent containing the same DAINIHON JOCHUGIKU CO., LTD. (JP) 2000-08-22 US disclosed
EP-0754674-A1 NOVEL CARBOXYLIC ESTER DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND INSECTICIDE OR INSECTIFUGE CONTAINING THE SAME DAINIHON JOCHUGIKU CO., LTD. (JP) 1997-01-22 EP disclosed