SCHEMBL4067599

SCHEMBL4067599

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 4/20 0.45
CES2 O00748 3/20 0.45
CES1 P23141 3/20 0.45
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MAPT P10636 2/20 0.35
RAB9A P51151 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HSP90AA1 P07900 1/20 0.35
ATM Q13315 1/20 0.35
HTT P42858 2/20 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
SCHEMBL5999756 0.91 CES2 (0.53) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL29130635 0.89 CES2 (0.52) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL1150848 0.81 LMNA (0.44) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL22367586 0.81 CES2 (0.44) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL7543173 0.78 CES2 (0.44) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL4067604 0.77 LMNA (0.45) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL4809206 0.74 PGR (0.46) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL7542392 0.73 LMNA (0.42) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL7542397 0.73 SLC6A2 (0.42) LMNACES2CES1SLC6A2SLC6A4
SCHEMBL28301980 0.73 KDM4E (0.42) LMNAKDM4EALDH1A1MEN1KMT2A

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