SCHEMBL4067604

SCHEMBL4067604

Cc1cc(C)c(C(=O)C(O)c2ccccc2)c(C)c1.c1ccc(Pc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
MAPK1 P28482 1/20 0.41
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 2/20 0.38
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
PSMB5 P28074 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
BRD4 O60885 1/20 0.33

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
SCHEMBL5999762 0.91 LMNA (0.53) LMNACES2CES1MAPK1SLC6A2
SCHEMBL29130636 0.89 LMNA (0.52) LMNACES2CES1MAPK1SLC6A2
SCHEMBL1150849 0.81 LMNA (0.44) LMNACES2CES1MAPK1SLC6A2
SCHEMBL2035885 0.81 LMNA (0.44) LMNACES2CES1MAPK1SLC6A2
SCHEMBL954446 0.81 LMNA (0.44) LMNACES2CES1MAPK1SLC6A2
SCHEMBL2035884 0.81 LMNA (0.44) LMNACES2CES1MAPK1SLC6A2
SCHEMBL14659767 0.81 LMNA (0.44) LMNACES2CES1MAPK1SLC6A2
SCHEMBL28301980 0.79 KDM4E (0.42) LMNAMAPK1ALDH1A1KDM4EHPGD
SCHEMBL4067599 0.77 LMNA (0.45) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL7531729 0.76 KMT2A (0.38) LMNAALDH1A1KDM4EHPGDNFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2878591-B1 RADICALLY CURABLE COMPOUND, METHOD FOR PRODUCING RADICALLY CURABLE COMPOUND, RADICALLY CURABLE COMPOSITION, CURED PRODUCT THEREOF, AND COMPOSITION FOR RESIST MATERIAL DAINIPPON INK & CHEMICALS (JP) 2020-09-16 EP disclosed
EP-1302514-B1 Active energy ray-curable antistatic coating composition MITSUBISHI CHEM CORP (JP) 2009-07-15 EP disclosed