SCHEMBL6520282

SCHEMBL6520282

C=C(CC(=O)OC)C(=O)OCC(=O)Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
PAM P19021 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
MAPT P10636 2/20 0.39
KLK7 P49862 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL6523964 0.88 TDP1 (0.40) ALDH1A1KDM4ELMNAPAML3MBTL1
SCHEMBL6515990 0.87 CYP19A1 (0.46) ALDH1A1PAML3MBTL1MAPK1SMN1; SMN2
SCHEMBL6518196 0.84 KMT2A (0.46) ALDH1A1KDM4ELMNAPAML3MBTL1
SCHEMBL6521074 0.83 ALDH1A1 (0.49) ALDH1A1KDM4ELMNAL3MBTL1MAPK1
SCHEMBL698394 0.82 ALDH1A1 (0.51) ALDH1A1KDM4ELMNAL3MBTL1MAPK1
SCHEMBL6520262 0.81 ALDH1A1 (0.44) ALDH1A1LMNAKMT2ATSHRMAPT
SCHEMBL6515141 0.81 CYP19A1 (0.44) ALDH1A1KDM4ELMNAPAML3MBTL1
SCHEMBL6519457 0.80 ALDH1A1 (0.49) ALDH1A1KDM4ELMNAL3MBTL1MAPK1
SCHEMBL6515547 0.79 KMT2A (0.48) ALDH1A1KDM4ELMNAL3MBTL1MAPK1
SCHEMBL6515808 0.78 KMT2A (0.44) ALDH1A1LMNAL3MBTL1SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed