SCHEMBL5087030

SCHEMBL5087030

[CH2]COCC(O)COc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
CYP2D6 P10635 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ADRB2 P07550 1/20 0.51
ADRB1 P08588 1/20 0.51
ADRB3 P13945 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MAPT P10636 3/20 0.49
TSHR P16473 1/20 0.49
HIF1A Q16665 1/20 0.49
RECQL P46063 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
OPRM1 P35372 1/20 0.46
OPRD1 P41143 1/20 0.46
AGER Q15109 1/20 0.44

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
SCHEMBL11400908 0.88 LMNA (0.61) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL267463 0.86 LMNA (0.68) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL25688271 0.85 LMNA (0.57) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL11108265 0.82 LMNA (0.59) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL23135358 0.81 LMNA (0.53) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL11959217 0.81 LMNA (0.58) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL11950503 0.81 CYP2D6 (0.49) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL7934497 0.81 LMNA (0.53) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL7809097 0.81 CYP2D6 (0.49) LMNACYP2D6L3MBTL1ADRB2ADRB1
SCHEMBL10710354 0.80 RECQL (0.57) LMNACYP2D6L3MBTL1ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1792940-B1 ACRYLIC SOL COMPOSITION ADEKA CORP (JP) 2008-10-22 EP disclosed
US-20070251415-A1 Acrylic Sol Composition ADEKA CORPORATION (JP) 2007-11-01 US disclosed
EP-1792940-A1 ACRYLIC SOL COMPOSITION Adeka Corporation (JP) 2007-06-06 EP disclosed