SCHEMBL25189809

SCHEMBL25189809

CCCCOc1cc(N(CC)c2ccccc2)ccc1C1(c2c(-c3ccccc3)n(CC)c3ccccc23)OC(=O)c2ncccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
EGFR P00533 1/20 0.33
ALDH1A1 P00352 3/20 0.32
CLK1 P49759 1/20 0.32
GRIK2 Q13002 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
SRC P12931 3/20 0.31
LYN P07948 3/20 0.31
BTK Q06187 2/20 0.31
RXRA P19793 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
TNF P01375 1/20 0.31
LITAF Q99732 1/20 0.31
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL21142026 0.93 GSK3A (0.35) GSK3AGSK3BEGFRALDH1A1CLK1
SCHEMBL25191553 0.93 GSK3A (0.38) GSK3AGSK3BALDH1A1CLK1GRIK2
SCHEMBL25190734 0.92 ALDH1A1 (0.32) GSK3AGSK3BALDH1A1KDM4ERXRA
SCHEMBL25188566 0.89 CLK1 (0.33) GSK3AGSK3BEGFRALDH1A1CLK1
SCHEMBL21142027 0.87 GSK3A (0.38) GSK3AGSK3BALDH1A1CLK1GRIK2
SCHEMBL25199444 0.85 ALDH1A1 (0.35) GSK3AGSK3BALDH1A1KDM4EHPGD
SCHEMBL21142025 0.83 CLK1 (0.33) GSK3AGSK3BEGFRALDH1A1CLK1
SCHEMBL25187571 0.82 ALDH1A1 (0.34) GSK3AGSK3BALDH1A1CLK1GRIK2
SCHEMBL25190560 0.82 ALDH1A1 (0.32) ALDH1A1RXRASMN1; SMN2LMNAHTT
SCHEMBL25193420 0.81 GSK3A (0.36) GSK3AGSK3BALDH1A1CLK1KDM4E

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