SCHEMBL27595142

SCHEMBL27595142

COc1cccc(OC(=O)CCCCC(=O)Oc2cccc(OC)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.60
ERBB2 P04626 1/20 0.60
LMNA P02545 2/20 0.53
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
GAA P10253 1/20 0.49
KMT2A Q03164 3/20 0.48
HSD17B10 Q99714 2/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
PARP1 P09874 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ACHE P22303 1/20 0.47
EPHX2 P34913 1/20 0.47

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
SCHEMBL28712193 0.96 EGFR (0.64) EGFRERBB2LMNACES2CES1
SCHEMBL27951879 0.94 LMNA (0.55) EGFRERBB2LMNACES2CES1
SCHEMBL3451753 0.93 LMNA (0.56) EGFRERBB2LMNACES2CES1
SCHEMBL28188561 0.92 EGFR (0.56) EGFRERBB2LMNAKMT2AMEN1
SCHEMBL27473758 0.90 EGFR (0.58) EGFRERBB2LMNACES2CES1
SCHEMBL1820340 0.88 MTNR1B (0.55) EGFRERBB2LMNACES2CES1
SCHEMBL12742253 0.86 LMNA (0.58) EGFRERBB2LMNACES2CES1
SCHEMBL8386903 0.86 EGFR (0.52) EGFRERBB2LMNACES2CES1
SCHEMBL10407331 0.86 KMT2A (0.60) KMT2AMEN1ALDH1A1SMN1; SMN2ACHE
SCHEMBL17138133 0.86 LMNA (0.49) EGFRERBB2LMNAKMT2AHSD17B10

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
CN-100408614-C Method for producing polycarbonate GEN ELECTRIC (US) 2008-08-06 CN disclosed
CN-1561356-A Method for producing polycarbonate GEN ELECTRIC (US) 2005-01-05 CN disclosed