SCHEMBL4293775

SCHEMBL4293775

C=Cc1ccc(C(C(=O)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.69
TDP1 Q9NUW8 1/20 0.69
LMNA P02545 5/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
PTPN1 P18031 1/20 0.51
ALDH1A1 P00352 4/20 0.43
TSHR P16473 1/20 0.43
AKT1 P31749 1/20 0.41
CYP3A4 P08684 1/20 0.40
S1PR3 Q99500 1/20 0.40
HDAC2 Q92769 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B2 P37059 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC10 Q969S8 1/20 0.39

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
SCHEMBL6930896 0.84 LMNA (0.69) L3MBTL1TDP1LMNACES2CES1
SCHEMBL2927912 0.83 L3MBTL1 (1.00) L3MBTL1TDP1LMNACES2CES1
SCHEMBL9282441 0.81 LMNA (0.69) L3MBTL1TDP1LMNACES2CES1
SCHEMBL17583575 0.78 L3MBTL1 (0.80) L3MBTL1TDP1LMNACES2CES1
SCHEMBL17583713 0.78 L3MBTL1 (0.80) L3MBTL1TDP1LMNACES2CES1
SCHEMBL16807278 0.78 L3MBTL1 (0.80) L3MBTL1TDP1LMNACES2CES1
SCHEMBL14338105 0.78 SRC (0.52) L3MBTL1TDP1LMNACES2CES1
Biphenyl SCHEMBL28656314 0.77 L3MBTL1 (0.87) L3MBTL1TDP1LMNACES2CES1
SCHEMBL2928039 0.77 L3MBTL1 (0.77) L3MBTL1TDP1LMNACES2CES1
SCHEMBL16807287 0.77 L3MBTL1 (0.77) L3MBTL1TDP1LMNACES2CES1

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-20090267489-A1 GAS BARRIER THIN FILM LAMINATE, GAS BARRIER RESIN SUBSTRATE AND ORGANIC EL DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2009-10-29 US disclosed