SCHEMBL30449491

SCHEMBL30449491

OCCOCCOCC(O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
CYP2D6 P10635 2/20 0.36
ABCB11 O95342 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2A P08913 1/20 0.36
DRD2 P14416 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
DRD4 P21917 1/20 0.36
HRH2 P25021 1/20 0.36
HTR2A P28223 1/20 0.36
HTR7 P34969 1/20 0.36
ADRA1A P35348 1/20 0.36
HRH1 P35367 1/20 0.36

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
SCHEMBL8837196 0.90 LMNA (0.44) ALDH1A1RECQLLMNAMEN1KMT2A
SCHEMBL28207428 0.90 LMNA (0.44) ALDH1A1RECQLLMNAMEN1KMT2A
SCHEMBL10615156 0.90 LMNA (0.44) ALDH1A1RECQLLMNAMEN1KMT2A
SCHEMBL8151932 0.86 LMNA (0.47) ALDH1A1RECQLLMNACYP2D6ABCB11
SCHEMBL7541159 0.84 TSHR (0.39) ALDH1A1RECQLLMNAMEN1KMT2A
Biphenyl SCHEMBL11060972 0.80 ALDH1A1 (0.56) ALDH1A1RECQLLMNAMEN1KMT2A
Biphenyl SCHEMBL28144699 0.80 ALDH1A1 (0.56) ALDH1A1RECQLLMNAMEN1KMT2A
SCHEMBL16070680 0.80 KMT2A (0.36) MEN1KMT2A
Acrylic Acid SCHEMBL2376425 0.79 CYP2C19 (0.36) ALDH1A1LMNAMEN1KMT2ACYP2D6
Acrylic Acid SCHEMBL30993977 0.79 CYP2C19 (0.36) ALDH1A1LMNAMEN1KMT2ACYP2D6

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
WO-2023085225-A1 METHOD FOR MANUFACTURING RECYCLED RESIN COMPOSITION 住友化学株式会社 2023-05-19 WO disclosed